1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid

C15H20FNO2 — CID 62270527

IUPAC1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid
SMILESCN(Cc1ccc(F)cc1)CC1(C(=O)O)CCCC1
InChIInChI=1S/C15H20FNO2/c1-17(10-12-4-6-13(16)7-5-12)11-15(14(18)19)8-2-3-9-15/h4-7H,2-3,8-11H2,1H3,(H,18,19)
InChIKeyOMVXOCCDPWUVCG-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.90
Rot. Bonds5

About 1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid

1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid (PubChem CID 62270527) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is 1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid
PubChem CID62270527
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC Name1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid
SMILESCN(Cc1ccc(F)cc1)CC1(C(=O)O)CCCC1
InChIInChI=1S/C15H20FNO2/c1-17(10-12-4-6-13(16)7-5-12)11-15(14(18)19)8-2-3-9-15/h4-7H,2-3,8-11H2,1H3,(H,18,19)
InChIKeyOMVXOCCDPWUVCG-UHFFFAOYSA-N
XLogP2.90
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid 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)methyl-methylamino]methyl]cyclobutane-1-carboxylic acid
CID 115246561
1-[[methyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]cyclopropane-1-carboxylic acid
CID 115242988
1-[[(2-fluorophenyl)methyl-methylamino]methyl]cyclohexane-1-carboxylic acid
CID 62270870
4-[[(4-methoxyphenyl)methyl-methylamino]methyl]oxane-4-carboxylic acid
CID 62390142
1-[[(3-methoxyphenyl)methyl-methylamino]methyl]cyclohexane-1-carboxylic acid
CID 62269993
4-[[methyl(pyridin-4-ylmethyl)amino]methyl]oxane-4-carboxylic acid
CID 62392237
1-[[[(4-fluorophenyl)methyl-methylcarbamoyl]amino]methyl]cyclopropane-1-carboxylic acid
CID 115451335
1-[[2-(3-fluorophenyl)ethyl-methylamino]methyl]cyclobutane-1-carboxylic acid
CID 115246649
N-[(4-fluorophenyl)methyl]-1-(hydroxymethyl)-N-methylcyclopropane-1-carboxamide
CID 115182311
1-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 62271764
1-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 55055654
4-[[(1-hydroxycyclopentyl)methyl-methylamino]methyl]benzoic acid
CID 65212652

Frequently Asked Questions

What is the IUPAC name of 1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid (CID 62270527) is 1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid is CN(Cc1ccc(F)cc1)CC1(C(=O)O)CCCC1.
What is the InChIKey of 1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid?
The InChIKey is OMVXOCCDPWUVCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c1-17(10-12-4-6-13(16)7-5-12)11-15(14(18)19)8-2-3-9-15/h4-7H,2-3,8-11H2,1H3,(H,18,19).
What are the key properties of 1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid?
1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid has a molecular weight of 265.33 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 62270527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).