tert-Butyl n-((1r,3r)-3-aminocyclopentyl)carbamate

C₁₀H₂₀N₂O₂CAS 1009075-44-8200.28 g/mol

Open in Covalent MOL file

Carbamate Primary amine

Properties

Molecular formula: C₁₀H₂₀N₂O₂
Molar mass: 200.28 g/mol
Exact mass: 200.1525 Da
logP: 1.39Crippen estimate
Polar surface area: 64.3 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 1
Stereocentres: R, Rin SMILES atom order

Hazards

Warning

H312 Harmful in contact with skin100% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264+P265, P280, P302+P352, P305+P351+P338, P317, P321, P337+P317, P362+P364, P501

Identifiers

CAS number

1009075-44-8

SMILES

CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C1)N

InChIKey

PGBVMVTUWHCOHX-HTQZYQBOSA-N

InChI

InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-8-5-4-7(11)6-8/h7-8H,4-6,11H2,1-3H3,(H,12,13)/t7-,8-/m1/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

tert-Butyl N-[(1R,3R)-3-aminocyclopentyl]carbamate

Work with tert-Butyl n-((1r,3r)-3-aminocyclopentyl)carbamate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Cis tert-Butyl 4-aminocyclohexylcarbamate177906-48-882 % similar Cis tert-Butyl 4-aminocyclohexylcarbamate247570-24-782 % similar exo-3-Boc-aminotropane132234-68-565 % similar rac-tert-Butyl N-[(1R,3R)-3-hydroxycyclopentyl]carbamate207729-04-264 % similar tert-Butyl (3-hydroxycyclobutyl)carbamate389890-43-161 % similar Boc-trans-4-aminocyclohexanol111300-06-259 % similar tert-Butyl cis-4-hydroxycyclohexylcarbamate167081-25-659 % similar 4-N-Boc-amino-cyclohexanol224309-64-259 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

tert-Butyl3-((methylamino)methyl)azetidine-1-carboxylate1049730-81-5 3-(N-Boc-methylaminomethyl)azetidine1053655-53-0 tert-Butyl 1,4-diazepane-1-carboxylate112275-50-0 (S)-1-N-Boc-2-(aminomethyl)pyrrolidine119020-01-8 tert-Butyl 3-methylpiperazine-1-carboxylate120737-59-9 tert-Butyl 2-methylpiperazine-1-carboxylate120737-78-2 1-Boc-3-aminopiperidine144243-24-3 (S)-4-N-Boc-2-methylpiperazine147081-29-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook