(1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine

C21H27N — CID 71032236

IUPAC(1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine
SMILESCC1CC[C@H](NCCC(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C21H27N/c1-17-12-13-20(16-17)22-15-14-21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,17,20-22H,12-16H2,1H3/t17?,20-/m0/s1
InChIKeyVAVUBYGDGJHLMP-OZBJMMHXSA-N
MW293.45 g/mol
LogP4.99
Rot. Bonds6

About (1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine

(1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine (PubChem CID 71032236) has the molecular formula C21H27N and a molecular weight of 293.45 g/mol. Its IUPAC name is (1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine.

Molecular Properties

Compound Name(1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine
PubChem CID71032236
Molecular FormulaC21H27N
Molecular Weight293.45 g/mol
Exact Mass293.21
IUPAC Name(1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine
SMILESCC1CC[C@H](NCCC(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C21H27N/c1-17-12-13-20(16-17)22-15-14-21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,17,20-22H,12-16H2,1H3/t17?,20-/m0/s1
InChIKeyVAVUBYGDGJHLMP-OZBJMMHXSA-N
XLogP4.99
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.45
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-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

N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine
CID 114547321
N'-(3-methylcyclopentyl)-1-phenylethane-1,2-diamine
CID 114547176
N-(3,3-diphenylpropyl)-1-propylpiperidin-4-amine
CID 2846321
N-(3-phenylbutyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 63463227
(2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol
CID 96784285
(2S)-4-[[(1S,3R)-3-methylcyclopentyl]amino]butan-2-ol
CID 124674906
N-[cyclopropyl(phenyl)methyl]-3-methylcyclopentan-1-amine
CID 64500445
1-N-(3-methylcyclopentyl)hexane-1,3-diamine
CID 114547292
3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine
CID 114543884
N-(3,3-dimethyl-1-phenylbutyl)-3-methylcyclopentan-1-amine
CID 64502336
3-methyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine
CID 107875909
1,5-dimethyl-N-(3-phenylbutyl)pyrrolidin-3-amine
CID 81333598

Frequently Asked Questions

What is the IUPAC name of (1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine?
The IUPAC name of (1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine (CID 71032236) is (1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine.
What is the SMILES notation for (1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine?
The canonical SMILES for (1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine is CC1CC[C@H](NCCC(c2ccccc2)c2ccccc2)C1.
What is the InChIKey of (1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine?
The InChIKey is VAVUBYGDGJHLMP-OZBJMMHXSA-N. The full InChI is InChI=1S/C21H27N/c1-17-12-13-20(16-17)22-15-14-21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,17,20-22H,12-16H2,1H3/t17?,20-/m0/s1.
What are the key properties of (1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine?
(1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine has a molecular weight of 293.45 g/mol, XLogP of 4.99, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine is sourced from PubChem (CID 71032236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).