4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide

C16H24N2O — CID 106778616

IUPAC4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide
SMILESCC(C)c1ccc(CC2CCNC(C(N)=O)C2)cc1
InChIInChI=1S/C16H24N2O/c1-11(2)14-5-3-12(4-6-14)9-13-7-8-18-15(10-13)16(17)19/h3-6,11,13,15,18H,7-10H2,1-2H3,(H2,17,19)
InChIKeyABOHVVMWMYMIHG-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.21
Rot. Bonds4

About 4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide

4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide (PubChem CID 106778616) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide
PubChem CID106778616
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide
SMILESCC(C)c1ccc(CC2CCNC(C(N)=O)C2)cc1
InChIInChI=1S/C16H24N2O/c1-11(2)14-5-3-12(4-6-14)9-13-7-8-18-15(10-13)16(17)19/h3-6,11,13,15,18H,7-10H2,1-2H3,(H2,17,19)
InChIKeyABOHVVMWMYMIHG-UHFFFAOYSA-N
XLogP2.21
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-[(4-propan-2-ylphenyl)methyl]piperidine-2-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

4-(naphthalen-1-ylmethyl)piperidine-2-carboxamide
CID 106778520
4-[(2,6-difluorophenyl)methyl]piperidine-2-carboxamide
CID 106781724
4-(aminomethyl)piperidine-2-carboxamide
CID 19078890
4-[(4-tert-butylphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 106778581
1-piperidin-2-yl-2-(4-propan-2-ylphenyl)ethanone
CID 116547889
4-[(2-fluoro-3-methoxyphenyl)methyl]piperidine-2-carboxamide
CID 106781147
N-[3-(4-propan-2-ylphenyl)propyl]azetidine-2-carboxamide
CID 131951887
4-[(1-ethylbenzimidazol-2-yl)methyl]piperidine-2-carboxamide
CID 106780314
(2S,4R)-4-hexylpiperidine-2-carboxamide
CID 142863438
[(2R,4S)-2-carbamoylpiperidin-4-yl]methylphosphonic acid
CID 14850749
2-[(4-propan-2-ylphenyl)methyl]pyrrolidine
CID 14921538
4-[(3,5-difluorophenyl)methyl]-N-ethylpiperidine-2-carboxamide
CID 106781871

Frequently Asked Questions

What is the IUPAC name of 4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide?
The IUPAC name of 4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide (CID 106778616) is 4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide.
What is the SMILES notation for 4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide?
The canonical SMILES for 4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide is CC(C)c1ccc(CC2CCNC(C(N)=O)C2)cc1.
What is the InChIKey of 4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide?
The InChIKey is ABOHVVMWMYMIHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-11(2)14-5-3-12(4-6-14)9-13-7-8-18-15(10-13)16(17)19/h3-6,11,13,15,18H,7-10H2,1-2H3,(H2,17,19).
What are the key properties of 4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide?
4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-propan-2-ylphenyl)methyl]piperidine-2-carboxamide is sourced from PubChem (CID 106778616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).