(2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine

C13H20N2 — CID 67673166

IUPAC(2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine
SMILESC[C@@H](c1ccccc1)C(N)N1CCCC1
InChIInChI=1S/C13H20N2/c1-11(12-7-3-2-4-8-12)13(14)15-9-5-6-10-15/h2-4,7-8,11,13H,5-6,9-10,14H2,1H3/t11-,13?/m0/s1
InChIKeyFMKGVAPNGYIVII-AMGKYWFPSA-N
MW204.32 g/mol
LogP2.17
Rot. Bonds3

About (2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine

(2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine (PubChem CID 67673166) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is (2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine.

Molecular Properties

Compound Name(2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine
PubChem CID67673166
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name(2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine
SMILESC[C@@H](c1ccccc1)C(N)N1CCCC1
InChIInChI=1S/C13H20N2/c1-11(12-7-3-2-4-8-12)13(14)15-9-5-6-10-15/h2-4,7-8,11,13H,5-6,9-10,14H2,1H3/t11-,13?/m0/s1
InChIKeyFMKGVAPNGYIVII-AMGKYWFPSA-N
XLogP2.17
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-[phenyl(piperidin-1-yl)methyl]phenyl]ethanamine
CID 67763745
(1R,2R)-1-phenyl-2-pyrrolidin-1-ylpropan-1-ol
CID 11830572
4-phenyl-3-piperidin-1-ylpentanoic acid
CID 64526249
1-[(1S)-2,2-dimethyl-1-phenylpropyl]pyrrolidine
CID 59470641
1-(3-methyl-1-phenylbutyl)piperidine
CID 3056530
(1R,2S)-3-methyl-1-phenyl-2-pyrrolidin-1-ylbutane-1-thiol
CID 23249782
1-[(1S)-3-methyl-1-phenylbutyl]piperidine
CID 92967702
(1R,2S)-3-methyl-1-phenyl-2-pyrrolidin-1-ylbutan-1-ol
CID 23249780
1-(4-benzhydrylpiperazin-1-yl)ethanamine
CID 68974612
ethane;[(2S)-3-phenylbutan-2-yl]benzene
CID 143602107
1-[(1S)-1-phenylethyl]-4-[(1R)-1-phenylethyl]piperazine
CID 3246046
(1S)-1-amino-2-phenylpropan-1-ol
CID 130442875

Frequently Asked Questions

What is the IUPAC name of (2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine?
The IUPAC name of (2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine (CID 67673166) is (2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine.
What is the SMILES notation for (2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine?
The canonical SMILES for (2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine is C[C@@H](c1ccccc1)C(N)N1CCCC1.
What is the InChIKey of (2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine?
The InChIKey is FMKGVAPNGYIVII-AMGKYWFPSA-N. The full InChI is InChI=1S/C13H20N2/c1-11(12-7-3-2-4-8-12)13(14)15-9-5-6-10-15/h2-4,7-8,11,13H,5-6,9-10,14H2,1H3/t11-,13?/m0/s1.
What are the key properties of (2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine?
(2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine has a molecular weight of 204.32 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-phenyl-1-pyrrolidin-1-ylpropan-1-amine is sourced from PubChem (CID 67673166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).