2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine

C18H21NO — CID 69111845

IUPAC2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine
SMILESCOc1ccc(-c2ccc(C3CCCC3N)cc2)cc1
InChIInChI=1S/C18H21NO/c1-20-16-11-9-14(10-12-16)13-5-7-15(8-6-13)17-3-2-4-18(17)19/h5-12,17-18H,2-4,19H2,1H3
InChIKeyUSJRHLNPNCUFLO-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.96
Rot. Bonds3

About 2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine

2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine (PubChem CID 69111845) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine
PubChem CID69111845
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine
SMILESCOc1ccc(-c2ccc(C3CCCC3N)cc2)cc1
InChIInChI=1S/C18H21NO/c1-20-16-11-9-14(10-12-16)13-5-7-15(8-6-13)17-3-2-4-18(17)19/h5-12,17-18H,2-4,19H2,1H3
InChIKeyUSJRHLNPNCUFLO-UHFFFAOYSA-N
XLogP3.96
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methoxy-4-[2-(4-methoxyphenyl)cyclohexyl]benzene
CID 101244821
trans-(1R,2S)-2-(4-propan-2-yloxyphenyl)cyclopentan-1-amine
CID 94605675
2-(3-methoxyphenyl)cyclopentan-1-amine
CID 62605139
1-methoxy-4-[(1S,2R)-2-methoxycyclohexyl]benzene
CID 138979383
4-[4-(2-aminocyclopentyl)phenyl]benzonitrile
CID 69112962
2-(4-ethoxyphenyl)cyclohexan-1-amine
CID 62800786
cis-(1R,2R)-2-(4-chlorophenyl)cyclopentan-1-amine
CID 11095547
2-(4-ethylphenyl)cyclopentan-1-amine
CID 62605664
2-(3-fluoro-4-methoxyphenyl)cyclopentan-1-amine
CID 62795099
2-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride
CID 21319672
1-cyclohexyl-4-(4-methoxyphenyl)benzene;ethene
CID 144983864
N-[[2-(4-methoxyphenyl)cyclopentyl]methyl]-2-methylpropan-2-amine
CID 81027158

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine?
The IUPAC name of 2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine (CID 69111845) is 2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine.
What is the SMILES notation for 2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine?
The canonical SMILES for 2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine is COc1ccc(-c2ccc(C3CCCC3N)cc2)cc1.
What is the InChIKey of 2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine?
The InChIKey is USJRHLNPNCUFLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-20-16-11-9-14(10-12-16)13-5-7-15(8-6-13)17-3-2-4-18(17)19/h5-12,17-18H,2-4,19H2,1H3.
What are the key properties of 2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine?
2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine has a molecular weight of 267.37 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine is sourced from PubChem (CID 69111845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).