Adamantan-1-yl-acetic acid hydrazide

C₁₂H₂₀N₂OCAS 19026-80-3208.30 g/mol

Open in Covalent MOL file

Amide Primary amine

Properties

Molecular formula: C₁₂H₂₀N₂O
Molar mass: 208.30 g/mol
Exact mass: 208.1576 Da
logP: 1.58Crippen estimate
Polar surface area: 55.1 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

19026-80-3

SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NN

InChIKey

ZORPHDZMMHDLAM-UHFFFAOYSA-N

InChI

InChI=1S/C12H20N2O/c13-14-11(15)7-12-4-8-1-9(5-12)3-10(2-8)6-12/h8-10H,1-7,13H2,(H,14,15)

Weigh it out

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

Names and synonyms

1 names

1-Adamantaneacetic hydrazide

Work with Adamantan-1-yl-acetic acid hydrazide

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

1-Adamantaneacetic acid4942-47-647 % similar Decanedihydrazide125-83-739 % similar Tricyclo(3.3.1.13,7)dec-1-ylmethylamine17768-41-137 % similar 1-Acetyladamantane1660-04-436 % similar Tricyclo(3.3.1.13,7)dec-1,3-diyldi(acetic acid)17768-28-436 % similar 4-Hydroxybutyric acid hydrazide3879-08-134 % similar Adamantyl bromomethyl ketone5122-82-734 % similar 1-Adamantanecarbonyl chloride2094-72-632 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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