2-Phenylpyrrolidine

C10H13NCAS 1006-64-0147.22 g/mol

Open in Covalent MOL file
NH
Secondary amine

Properties

Molecular formula
C10H13N
Molar mass
147.22 g/mol
Exact mass
147.1048 Da
logP
2.11Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, P501

Identifiers

CAS number
1006-64-0
SMILES
C1CC(NC1)C2=CC=CC=C2
InChIKey
JUTDHSGANMHVIC-UHFFFAOYSA-N
InChI
InChI=1S/C10H13N/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-3,5-6,10-11H,4,7-8H2

Weigh it out

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

Work with 2-Phenylpyrrolidine

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

2-Phenylpiperidine3466-80-688 % similar 4-(Pyrrolidin-2-yl)pyridine128562-25-464 % similar (R)-2-(4-Fluorophenyl)pyrrolidine298690-89-862 % similar (S)-2-(4-Fluorophenyl)pyrrolidine298690-90-162 % similar 2-(4-Bromophenyl)pyrrolidine383127-22-862 % similar 2-(4-Chlorophenyl)pyrrolidine38944-14-862 % similar 2-(4-Fluorophenyl)pyrrolidine72216-06-962 % similar 2-(3-Fluorophenyl)pyrrolidine298690-72-961 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,3,4,5-Tetrahydro-1H-benzo[B]azepine1701-57-1 2-Methyltetrahydroquinoline1780-19-4 (S)-1,2,3,4-Tetrahydro-2-naphthylamine21880-87-5 1,2,3,4-Tetrahydro-1-naphthylamine2217-40-5 5,6,7,8-Tetrahydro-1-naphthylamine2217-41-6 (-)-1,2,3,4-Tetrahydro-1-naphthylamine23357-46-2 (+)-1,2,3,4-Tetrahydro-1-naphthylamine23357-52-0 5,6,7,8-Tetrahydro-2-methylquinoline2617-98-3

Elsewhere

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