3-(Methylamino)-1-propanol

C₄H₁₁NOCAS 42055-15-289.14 g/mol

Open in Covalent MOL file

Alcohol Secondary amine

Properties

Molecular formula: C₄H₁₁NO
Molar mass: 89.14 g/mol
Exact mass: 89.0841 Da
logP: -0.41Crippen estimate
Polar surface area: 32.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 3

Hazards

Danger

H302 Harmful if swallowed97.6% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, P501

Identifiers

CAS number

42055-15-2

SMILES

CNCCCO

InChIKey

KRGXWTOLFOPIKV-UHFFFAOYSA-N

InChI

InChI=1S/C4H11NO/c1-5-3-2-4-6/h5-6H,2-4H2,1H3

Weigh it out

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

Work with 3-(Methylamino)-1-propanol

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

N-Methylethanolamine109-83-167 % similar N,N'-Dimethyl-1,3-propanediamine111-33-159 % similar N1,N6-Dimethyl-1,6-hexanediamine13093-04-456 % similar Methylbutylamine110-68-948 % similar N,N′-Dimethylethylenediamine110-70-347 % similar N-Methylpentylamine25419-06-145 % similar N-Methyl-1,3-propanediamine6291-84-545 % similar 4-(Isopropylamino)butanol42042-71-744 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-(Dimethylamino)ethanol108-01-0 2-(Ethylamino)ethanol110-73-6 Ethoxyethylamine110-76-9 Aminomethyl propanol124-68-5 2-Amino-1-butanol13054-87-0 4-Amino-1-butanol13325-10-5 1-Amino-2-butanol13552-21-1 1-Amino-2-methyl-2-propanol2854-16-2

Elsewhere

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