[1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine

C14H22N2 — CID 115311606

IUPAC[1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine
SMILESCCC(c1ccccc1)N1CCCC1CN
InChIInChI=1S/C14H22N2/c1-2-14(12-7-4-3-5-8-12)16-10-6-9-13(16)11-15/h3-5,7-8,13-14H,2,6,9-11,15H2,1H3
InChIKeyUKUBCXPAZIFZST-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.56
Rot. Bonds4

About [1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine

[1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine (PubChem CID 115311606) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is [1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine
PubChem CID115311606
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name[1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine
SMILESCCC(c1ccccc1)N1CCCC1CN
InChIInChI=1S/C14H22N2/c1-2-14(12-7-4-3-5-8-12)16-10-6-9-13(16)11-15/h3-5,7-8,13-14H,2,6,9-11,15H2,1H3
InChIKeyUKUBCXPAZIFZST-UHFFFAOYSA-N
XLogP2.56
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine 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-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine
CID 115311578
2-(2-ethylpiperidin-1-yl)-2-phenylethanamine
CID 43266409
[1-(1-phenylethyl)azepan-2-yl]methanamine
CID 116640530
[1-[1-(2-fluorophenyl)propyl]piperidin-2-yl]methanamine
CID 112679200
[1-(2,2,2-trifluoro-1-phenylethyl)pyrrolidin-2-yl]methanamine
CID 115312692
3-(2-ethylpyrrolidin-1-yl)-3-phenylpropanoic acid
CID 63075093
(2S)-2-[(2S)-2-ethylpiperidin-1-yl]-2-phenylethanol
CID 10609696
1-[1-(1-phenylpropyl)piperidin-3-yl]ethanamine;hydrochloride
CID 119925499
2-[1-[2-(aminomethyl)pyrrolidin-1-yl]propyl]-4-bromophenol
CID 113284186
[4-ethyl-1-(1-phenylbutyl)piperidin-2-yl]methanamine
CID 103351865
[4-methyl-1-(1-phenylbutyl)piperidin-2-yl]methanamine
CID 103440626
[1-(2,2-diphenylethyl)pyrrolidin-2-yl]methanamine
CID 107292865

Frequently Asked Questions

What is the IUPAC name of [1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine?
The IUPAC name of [1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine (CID 115311606) is [1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine.
What is the SMILES notation for [1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine?
The canonical SMILES for [1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine is CCC(c1ccccc1)N1CCCC1CN.
What is the InChIKey of [1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine?
The InChIKey is UKUBCXPAZIFZST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-2-14(12-7-4-3-5-8-12)16-10-6-9-13(16)11-15/h3-5,7-8,13-14H,2,6,9-11,15H2,1H3.
What are the key properties of [1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine?
[1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine has a molecular weight of 218.34 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine is sourced from PubChem (CID 115311606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).