N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide

C16H24N2O2 — CID 60570421

IUPACN-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide
SMILESCOc1cc(CNC(=O)N2CCCC(C)C2)ccc1C
InChIInChI=1S/C16H24N2O2/c1-12-5-4-8-18(11-12)16(19)17-10-14-7-6-13(2)15(9-14)20-3/h6-7,9,12H,4-5,8,10-11H2,1-3H3,(H,17,19)
InChIKeyOUUUIJIAVWTLOQ-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.95
Rot. Bonds3

About N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide

N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide (PubChem CID 60570421) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide
PubChem CID60570421
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide
SMILESCOc1cc(CNC(=O)N2CCCC(C)C2)ccc1C
InChIInChI=1S/C16H24N2O2/c1-12-5-4-8-18(11-12)16(19)17-10-14-7-6-13(2)15(9-14)20-3/h6-7,9,12H,4-5,8,10-11H2,1-3H3,(H,17,19)
InChIKeyOUUUIJIAVWTLOQ-UHFFFAOYSA-N
XLogP2.95
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-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

N-[(3-methoxy-4-methylphenyl)methyl]-4-methylpiperidine-1-carboxamide
CID 60570389
(3R)-N-[(2,4-dimethoxyphenyl)methyl]-3-methylpiperidine-1-carboxamide
CID 95663808
N-[(3,4-dimethoxyphenyl)methyl]piperidine-1-carboxamide
CID 108896757
N-[(3-bromo-4-methoxyphenyl)methyl]-3-hydroxypiperidine-1-carboxamide
CID 110922318
N-[(3,4-dimethoxyphenyl)methyl]-2-(3-methylpiperidin-1-yl)acetamide
CID 18083473
(3R)-3-cyano-N-[(4-hydroxy-3-methoxyphenyl)methyl]piperidine-1-carboxamide
CID 126452602
N-[(4-hydroxy-3-methoxyphenyl)methyl]azocane-1-carboxamide
CID 121497136
N-[2-(2-methoxy-4-methylphenoxy)ethyl]-3-methylpiperidine-1-carboxamide
CID 112975321
methyl 2-methoxy-5-[[[N-methyl-C-(3-methylpiperidin-1-yl)carbonimidoyl]amino]methyl]benzoate
CID 111145940
1-[(3S)-3-hydroxypiperidin-1-yl]-2-(3-methoxy-4-methylphenyl)ethanone
CID 107224910
2-(3,4-dimethylphenyl)-1-(3-methylpiperidin-1-yl)ethanone
CID 110766864
2-[(3-methoxy-4-methylphenyl)methylcarbamoyl]cyclobutane-1-carboxylic acid
CID 120975519

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide?
The IUPAC name of N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide (CID 60570421) is N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide is COc1cc(CNC(=O)N2CCCC(C)C2)ccc1C.
What is the InChIKey of N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide?
The InChIKey is OUUUIJIAVWTLOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12-5-4-8-18(11-12)16(19)17-10-14-7-6-13(2)15(9-14)20-3/h6-7,9,12H,4-5,8,10-11H2,1-3H3,(H,17,19).
What are the key properties of N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide?
N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxy-4-methylphenyl)methyl]-3-methylpiperidine-1-carboxamide is sourced from PubChem (CID 60570421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).