4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide

C13H17FN2O — CID 97357080

IUPAC4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide
SMILESNC(=O)C1(Cc2ccc(F)cc2)CCNCC1
InChIInChI=1S/C13H17FN2O/c14-11-3-1-10(2-4-11)9-13(12(15)17)5-7-16-8-6-13/h1-4,16H,5-9H2,(H2,15,17)
InChIKeyCPKMWFWOWKGLEW-UHFFFAOYSA-N
MW236.29 g/mol
LogP1.22
Rot. Bonds3

About 4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide

4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide (PubChem CID 97357080) has the molecular formula C13H17FN2O and a molecular weight of 236.29 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide
PubChem CID97357080
Molecular FormulaC13H17FN2O
Molecular Weight236.29 g/mol
Exact Mass236.13
IUPAC Name4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide
SMILESNC(=O)C1(Cc2ccc(F)cc2)CCNCC1
InChIInChI=1S/C13H17FN2O/c14-11-3-1-10(2-4-11)9-13(12(15)17)5-7-16-8-6-13/h1-4,16H,5-9H2,(H2,15,17)
InChIKeyCPKMWFWOWKGLEW-UHFFFAOYSA-N
XLogP1.22
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.29
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide 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-methylphenyl)methyl]cyclopropane-1-carboxamide
CID 123851701
4-benzylpiperidine-4-carboxylic acid
CID 18365178
N-[1-(4-fluorophenyl)propan-2-yl]-4-methylpiperidine-4-carboxamide
CID 63122933
N-[(4-fluorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127194
1-[(4-methoxyphenyl)methyl]cyclohexane-1-carboxamide
CID 69475295
3-[(4-fluorophenyl)methyl]oxolane-3-carboxylic acid
CID 62740795
N-[(4-fluorophenyl)methyl]-N-methyl-4-propylpiperidine-4-carboxamide
CID 63128063
1-[(4-fluorophenyl)methyl]-3-[(4-pyridin-4-ylphenyl)methyl]piperidine-3-carboxamide
CID 110232340
4-[(2,5-difluorophenyl)methyl]piperidine-4-carboxylic acid
CID 55178571
methyl 4-[(4-chlorophenyl)methyl]piperidine-4-carboxylate
CID 71158967
1-[4-[(4-fluoropiperidin-4-yl)methyl]phenyl]ethanone
CID 105496458
[1-[(4-fluorophenyl)methyl]cyclopropyl] 2-aminoacetate
CID 90873391

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide?
The IUPAC name of 4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide (CID 97357080) is 4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide is NC(=O)C1(Cc2ccc(F)cc2)CCNCC1.
What is the InChIKey of 4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide?
The InChIKey is CPKMWFWOWKGLEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O/c14-11-3-1-10(2-4-11)9-13(12(15)17)5-7-16-8-6-13/h1-4,16H,5-9H2,(H2,15,17).
What are the key properties of 4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide?
4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide has a molecular weight of 236.29 g/mol, XLogP of 1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 97357080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).