4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide

C15H23N3O — CID 63248764

IUPAC4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide
SMILESCNCC1CCN(C(=O)Nc2ccc(C)cc2)CC1
InChIInChI=1S/C15H23N3O/c1-12-3-5-14(6-4-12)17-15(19)18-9-7-13(8-10-18)11-16-2/h3-6,13,16H,7-11H2,1-2H3,(H,17,19)
InChIKeyTYVFLGROAKEXOT-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.46
Rot. Bonds3

About 4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide

4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide (PubChem CID 63248764) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide
PubChem CID63248764
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide
SMILESCNCC1CCN(C(=O)Nc2ccc(C)cc2)CC1
InChIInChI=1S/C15H23N3O/c1-12-3-5-14(6-4-12)17-15(19)18-9-7-13(8-10-18)11-16-2/h3-6,13,16H,7-11H2,1-2H3,(H,17,19)
InChIKeyTYVFLGROAKEXOT-UHFFFAOYSA-N
XLogP2.46
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(hydroxymethyl)-N-[4-(4-methylphenoxy)phenyl]piperidine-1-carboxamide
CID 48832439
4-[(4-methylcyclohexyl)methyl]-N-(4-methylphenyl)piperidine-1-carboxamide
CID 20930657
4-(azepan-1-ylmethyl)-N-(4-methylphenyl)piperidine-1-carboxamide
CID 20907581
N-(4-methylphenyl)-4-(2-oxo-2-pyrrolidin-1-ylethyl)piperidine-1-carboxamide
CID 53033008
1-N,4-N-bis(4-methylphenyl)piperazine-1,4-dicarboxamide
CID 4055899
3-(2-aminoethyl)-N-(4-methylphenyl)pyrrolidine-1-carboxamide
CID 114802216
1-N-methyl-4-N-(4-methylphenyl)piperazine-1,4-dicarboxamide
CID 23990210
N-(4-methylphenyl)-4-[2-(2-methylpropanoylamino)ethyl]piperidine-1-carboxamide
CID 91903591
N-(4-methylphenyl)-4-[2-oxo-2-(propylamino)ethyl]piperidine-1-carboxamide
CID 52998818
4-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-N-(4-methylphenyl)piperidine-1-carboxamide
CID 92731351
N-[4-[4-(methylaminomethyl)piperidine-1-carbonyl]phenyl]acetamide;hydrochloride
CID 119542570
4-cyclopropyl-N-(4-methylphenyl)piperazine-1-carboxamide
CID 47455397

Frequently Asked Questions

What is the IUPAC name of 4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide?
The IUPAC name of 4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide (CID 63248764) is 4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide?
The canonical SMILES for 4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide is CNCC1CCN(C(=O)Nc2ccc(C)cc2)CC1.
What is the InChIKey of 4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide?
The InChIKey is TYVFLGROAKEXOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-12-3-5-14(6-4-12)17-15(19)18-9-7-13(8-10-18)11-16-2/h3-6,13,16H,7-11H2,1-2H3,(H,17,19).
What are the key properties of 4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide?
4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 63248764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).