3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine

C17H25N — CID 167085192

IUPAC3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine
SMILESNC1CCC(Cc2ccc(C3CCCC3)cc2)C1
InChIInChI=1S/C17H25N/c18-17-10-7-14(12-17)11-13-5-8-16(9-6-13)15-3-1-2-4-15/h5-6,8-9,14-15,17H,1-4,7,10-12,18H2
InChIKeyWEOBIAFFFHTOQE-UHFFFAOYSA-N
MW243.39 g/mol
LogP4.01
Rot. Bonds3

About 3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine

3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine (PubChem CID 167085192) has the molecular formula C17H25N and a molecular weight of 243.39 g/mol. Its IUPAC name is 3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine
PubChem CID167085192
Molecular FormulaC17H25N
Molecular Weight243.39 g/mol
Exact Mass243.20
IUPAC Name3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine
SMILESNC1CCC(Cc2ccc(C3CCCC3)cc2)C1
InChIInChI=1S/C17H25N/c18-17-10-7-14(12-17)11-13-5-8-16(9-6-13)15-3-1-2-4-15/h5-6,8-9,14-15,17H,1-4,7,10-12,18H2
InChIKeyWEOBIAFFFHTOQE-UHFFFAOYSA-N
XLogP4.01
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-[(4-tert-butylphenyl)methyl]cyclopentan-1-amine
CID 64506233
3-(4-cyclobutylphenyl)cyclopentan-1-amine
CID 116506752
3-[(4-ethylphenyl)methyl]cyclohexan-1-amine
CID 64506247
3-[(4-fluorophenyl)methyl]cyclohexan-1-amine
CID 64504117
1-(cyclopentylmethyl)-4-(4-propylcyclohexyl)benzene
CID 71773137
3-[(4-cyclobutylphenyl)methyl]piperidine
CID 84793090
(4-cyclohexylphenyl)methanamine
CID 22246867
1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene
CID 163396253
(3R)-3-benzylcyclohexan-1-amine
CID 168960646
4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine
CID 139515276
3-[4-(piperidin-3-ylmethyl)phenyl]piperidine
CID 116988274
trans-(1S,3S)-3-[(5-cyclopropylpyrimidin-2-yl)methyl]cyclopentan-1-amine
CID 157284559

Frequently Asked Questions

What is the IUPAC name of 3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine?
The IUPAC name of 3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine (CID 167085192) is 3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine?
The canonical SMILES for 3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine is NC1CCC(Cc2ccc(C3CCCC3)cc2)C1.
What is the InChIKey of 3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine?
The InChIKey is WEOBIAFFFHTOQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N/c18-17-10-7-14(12-17)11-13-5-8-16(9-6-13)15-3-1-2-4-15/h5-6,8-9,14-15,17H,1-4,7,10-12,18H2.
What are the key properties of 3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine?
3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine has a molecular weight of 243.39 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-cyclopentylphenyl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 167085192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).