3-cyclopentyl-3-(4-methylphenyl)propan-1-amine

C15H23N — CID 82079151

IUPAC3-cyclopentyl-3-(4-methylphenyl)propan-1-amine
SMILESCc1ccc(C(CCN)C2CCCC2)cc1
InChIInChI=1S/C15H23N/c1-12-6-8-14(9-7-12)15(10-11-16)13-4-2-3-5-13/h6-9,13,15H,2-5,10-11,16H2,1H3
InChIKeyRRAUMEXXEKXOTL-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.62
Rot. Bonds4

About 3-cyclopentyl-3-(4-methylphenyl)propan-1-amine

3-cyclopentyl-3-(4-methylphenyl)propan-1-amine (PubChem CID 82079151) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 3-cyclopentyl-3-(4-methylphenyl)propan-1-amine.

Molecular Properties

Compound Name3-cyclopentyl-3-(4-methylphenyl)propan-1-amine
PubChem CID82079151
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name3-cyclopentyl-3-(4-methylphenyl)propan-1-amine
SMILESCc1ccc(C(CCN)C2CCCC2)cc1
InChIInChI=1S/C15H23N/c1-12-6-8-14(9-7-12)15(10-11-16)13-4-2-3-5-13/h6-9,13,15H,2-5,10-11,16H2,1H3
InChIKeyRRAUMEXXEKXOTL-UHFFFAOYSA-N
XLogP3.62
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclobutyl-2-(4-methylphenyl)ethanamine
CID 55269565
3-(4-butan-2-ylphenyl)-3-cyclopentylpropan-1-amine
CID 112516776
3-cyclopentyl-3-(4-methylphenyl)propanamide
CID 19938383
(3R)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-(4-methylphenyl)propan-1-amine
CID 751685
(1R,5R)-1,5-dicyclopentyl-1,5-bis(4-methylphenyl)pentan-3-one
CID 97304287
2-cycloheptyl-N-methyl-2-(4-methylphenyl)ethanamine
CID 82933613
3-cyclopentyl-3-(4-methylphenyl)propanoic acid
CID 19938398
2-cyclopentyl-2-(4-propan-2-ylphenyl)ethanamine
CID 79022519
3-cyclobutyl-3-(4-ethoxy-3-methylphenyl)propan-1-amine
CID 112515939
3-cyclopentyl-3-(3-ethyl-4-methoxyphenyl)propan-1-amine
CID 112516911
3-(3-chlorophenyl)-3-cyclohexylpropan-1-amine
CID 82087861
3-cyclohexyl-3-(3-fluorophenyl)propan-1-amine
CID 82083463

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-3-(4-methylphenyl)propan-1-amine?
The IUPAC name of 3-cyclopentyl-3-(4-methylphenyl)propan-1-amine (CID 82079151) is 3-cyclopentyl-3-(4-methylphenyl)propan-1-amine.
What is the SMILES notation for 3-cyclopentyl-3-(4-methylphenyl)propan-1-amine?
The canonical SMILES for 3-cyclopentyl-3-(4-methylphenyl)propan-1-amine is Cc1ccc(C(CCN)C2CCCC2)cc1.
What is the InChIKey of 3-cyclopentyl-3-(4-methylphenyl)propan-1-amine?
The InChIKey is RRAUMEXXEKXOTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-12-6-8-14(9-7-12)15(10-11-16)13-4-2-3-5-13/h6-9,13,15H,2-5,10-11,16H2,1H3.
What are the key properties of 3-cyclopentyl-3-(4-methylphenyl)propan-1-amine?
3-cyclopentyl-3-(4-methylphenyl)propan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-3-(4-methylphenyl)propan-1-amine is sourced from PubChem (CID 82079151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).