(2S)-N-Phenyl-2-pyrrolidinemethanamine
Properties
- Molecular formula
- C11H16N2
- Molar mass
- 176.26 g/mol
- Exact mass
- 176.1313 Da
- Boiling point
- 111–112 °C (at 0.55 Torr)
- logP
- 1.85Crippen estimate
- Polar surface area
- 24.1 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 3
- Stereocentres
- Sin SMILES atom order
Hazards
Danger
- H314 Causes severe skin burns and eye damage100% of notifiers
Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501
Identifiers
CAS number
64030-44-0SMILES
c1ccc(NC[C@@H]2CCCN2)cc1InChIKey
MCHWKJRTMPIHRA-NSHDSACASA-NInChI
InChI=1S/C11H16N2/c1-2-5-10(6-3-1)13-9-11-7-4-8-12-11/h1-3,5-6,11-13H,4,7-9H2/t11-/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- 2-Pyrrolidinemethanamine, N-phenyl-, (2S)-
- 2-Pyrrolidinemethanamine, N-phenyl-, (S)-
- (S)-2-(Anilinomethyl)pyrrolidine
- (S)-2-(Phenylaminomethyl)pyrrolidine
- (2S)-(Anilinomethyl)pyrrolidine
- (S)-(+)-2-(Anilinomethyl)pyrrolidine
- (+)-2-(Anilinomethyl)pyrrolidine
- (2S)-2-Phenylaminomethylpyrrolidine
- (S)-N-(Pyrrolidin-2-ylmethyl)aniline
- 2-Pyrrolidinemethanamine N-phenyl-, (2S)-
Work with (2S)-N-Phenyl-2-pyrrolidinemethanamine
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
(S)-(+)-2-(2,6-Xylidinomethyl)pyrrolidine70371-56-156 % similar
2-Benzylpiperidine32838-55-452 % similar
N-Cyclohexylbenzenamine1821-36-947 % similar
N,N'-Diphenylethylenediamine150-61-846 % similar
2-Phenylpyrrolidine1006-64-045 % similar
(2S)-2-(Diphenylmethyl)pyrrolidine119237-64-843 % similar
(R)-(+)-2-(Diphenylmethyl)pyrrolidine22348-31-843 % similar
Benzylaniline103-32-242 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.