N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide

C14H20N2O2 — CID 113397758

IUPACN-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide
SMILESCC1(C(=O)Nc2ccc(CO)cc2)CCCNC1
InChIInChI=1S/C14H20N2O2/c1-14(7-2-8-15-10-14)13(18)16-12-5-3-11(9-17)4-6-12/h3-6,15,17H,2,7-10H2,1H3,(H,16,18)
InChIKeyWCAWAIQJLIJIJN-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.51
Rot. Bonds3

About N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide

N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide (PubChem CID 113397758) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide
PubChem CID113397758
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide
SMILESCC1(C(=O)Nc2ccc(CO)cc2)CCCNC1
InChIInChI=1S/C14H20N2O2/c1-14(7-2-8-15-10-14)13(18)16-12-5-3-11(9-17)4-6-12/h3-6,15,17H,2,7-10H2,1H3,(H,16,18)
InChIKeyWCAWAIQJLIJIJN-UHFFFAOYSA-N
XLogP1.51
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-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

3-methyl-N-(4-propylphenyl)piperidine-3-carboxamide
CID 63130315
N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943521
3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide
CID 63131065
3-methyl-N-(4-pentylphenyl)piperidine-3-carboxamide
CID 63134870
N-[(4-acetamidophenyl)methyl]-3-methylpiperidine-3-carboxamide
CID 63134873
N-(4-methoxyphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943571
N-[4-(ethylcarbamoyl)phenyl]-3-methylpiperidine-3-carboxamide
CID 63131115
3-methyl-N-pyridin-4-ylpiperidine-3-carboxamide;dihydrochloride
CID 119946059
3-methyl-N-[4-(triazol-2-yl)phenyl]piperidine-3-carboxamide
CID 63130247
3-methyl-N-[[4-(2-methylpropanoylamino)phenyl]methyl]piperidine-3-carboxamide
CID 119944132
3-methyl-N-(4-propan-2-yloxyphenyl)piperidine-3-carboxamide;hydrochloride
CID 119944238
N-[4-(2-amino-2-oxoethoxy)phenyl]-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119944287

Frequently Asked Questions

What is the IUPAC name of N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide?
The IUPAC name of N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide (CID 113397758) is N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide.
What is the SMILES notation for N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide?
The canonical SMILES for N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide is CC1(C(=O)Nc2ccc(CO)cc2)CCCNC1.
What is the InChIKey of N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide?
The InChIKey is WCAWAIQJLIJIJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-14(7-2-8-15-10-14)13(18)16-12-5-3-11(9-17)4-6-12/h3-6,15,17H,2,7-10H2,1H3,(H,16,18).
What are the key properties of N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide?
N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.51, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide is sourced from PubChem (CID 113397758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).