[1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol

C14H20FNO — CID 63645721

IUPAC[1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol
SMILESCc1ccc(CNC2(CO)CCCC2)cc1F
InChIInChI=1S/C14H20FNO/c1-11-4-5-12(8-13(11)15)9-16-14(10-17)6-2-3-7-14/h4-5,8,16-17H,2-3,6-7,9-10H2,1H3
InChIKeyKLSAWBWTJOIMHO-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.53
Rot. Bonds4

About [1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol

[1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol (PubChem CID 63645721) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is [1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol
PubChem CID63645721
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name[1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol
SMILESCc1ccc(CNC2(CO)CCCC2)cc1F
InChIInChI=1S/C14H20FNO/c1-11-4-5-12(8-13(11)15)9-16-14(10-17)6-2-3-7-14/h4-5,8,16-17H,2-3,6-7,9-10H2,1H3
InChIKeyKLSAWBWTJOIMHO-UHFFFAOYSA-N
XLogP2.53
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol 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-[(4-fluoro-3-methylphenyl)methylamino]cyclohexyl]methanol
CID 62521694
[1-[(3,4-dimethylphenyl)methylamino]cyclobutyl]methanol
CID 115733318
[1-[(4-methyl-3-nitrophenyl)methylamino]cyclopentyl]methanol
CID 62523971
[1-[(4-fluoro-3-methylphenyl)methylamino]-4-methylcyclohexyl]methanol
CID 62553502
[1-[(4-ethylphenyl)methylamino]cyclopentyl]methanol
CID 62524121
[1-[(3,4-dimethoxyphenyl)methylamino]cyclobutyl]methanol
CID 115733291
[1-[[4-(difluoromethyl)phenyl]methylamino]cyclohexyl]methanol
CID 115523953
N-[(4-chloro-3-fluorophenyl)methyl]-1-(chloromethyl)cyclopentan-1-amine
CID 107887426
[1-[(4-bromo-2-fluorophenyl)methylamino]cyclopentyl]methanol
CID 62522578
[3-methyl-1-[(3,4,5-trifluorophenyl)methylamino]cyclohexyl]methanol
CID 63051065
[1-[(4-butoxyphenyl)methylamino]cyclohexyl]methanol
CID 62520257
[1-[(2-fluorophenyl)methylamino]cyclohexyl]methanol
CID 55082363

Frequently Asked Questions

What is the IUPAC name of [1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol?
The IUPAC name of [1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol (CID 63645721) is [1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol.
What is the SMILES notation for [1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol?
The canonical SMILES for [1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol is Cc1ccc(CNC2(CO)CCCC2)cc1F.
What is the InChIKey of [1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol?
The InChIKey is KLSAWBWTJOIMHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-11-4-5-12(8-13(11)15)9-16-14(10-17)6-2-3-7-14/h4-5,8,16-17H,2-3,6-7,9-10H2,1H3.
What are the key properties of [1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol?
[1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol has a molecular weight of 237.32 g/mol, XLogP of 2.53, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3-fluoro-4-methylphenyl)methylamino]cyclopentyl]methanol is sourced from PubChem (CID 63645721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).