4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide

C16H23N3O2 — CID 63121646

IUPAC4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide
SMILESCNC(=O)Cc1ccc(NC(=O)C2(C)CCNCC2)cc1
InChIInChI=1S/C16H23N3O2/c1-16(7-9-18-10-8-16)15(21)19-13-5-3-12(4-6-13)11-14(20)17-2/h3-6,18H,7-11H2,1-2H3,(H,17,20)(H,19,21)
InChIKeyPTBKTOAIKBGXAS-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.30
Rot. Bonds4

About 4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide

4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide (PubChem CID 63121646) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide
PubChem CID63121646
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide
SMILESCNC(=O)Cc1ccc(NC(=O)C2(C)CCNCC2)cc1
InChIInChI=1S/C16H23N3O2/c1-16(7-9-18-10-8-16)15(21)19-13-5-3-12(4-6-13)11-14(20)17-2/h3-6,18H,7-11H2,1-2H3,(H,17,20)(H,19,21)
InChIKeyPTBKTOAIKBGXAS-UHFFFAOYSA-N
XLogP1.30
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-(4-methylphenyl)piperidine-4-carboxamide
CID 63121506
4-methyl-N-[4-(methylsulfamoyl)phenyl]piperidine-4-carboxamide
CID 63121716
N-(4-carbamoylphenyl)-4-methylpiperidine-4-carboxamide
CID 63121565
N-[4-(2-amino-2-oxoethyl)phenyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120620858
4-methyl-N-[3-(propanoylamino)phenyl]piperidine-4-carboxamide
CID 63122404
4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide
CID 66352171
4-ethyl-N-(4-ethylphenyl)piperidine-4-carboxamide
CID 63127797
4-methyl-N-(3,4,5-trifluorophenyl)piperidine-4-carboxamide
CID 55177366
N-(4-tert-butylphenyl)-3-methylpyrrolidine-3-carboxamide
CID 55165707
4-(methoxymethyl)-N-[4-[2-(methylamino)-2-oxoethoxy]phenyl]piperidine-4-carboxamide;hydrochloride
CID 120631273
2-[[2-[4-[(1-methylcycloheptanecarbonyl)amino]phenyl]acetyl]amino]acetic acid
CID 120523468
N-(3-acetamido-4-methylphenyl)-4-methylpiperidine-4-carboxamide
CID 63121630

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide?
The IUPAC name of 4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide (CID 63121646) is 4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide.
What is the SMILES notation for 4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide?
The canonical SMILES for 4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide is CNC(=O)Cc1ccc(NC(=O)C2(C)CCNCC2)cc1.
What is the InChIKey of 4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide?
The InChIKey is PTBKTOAIKBGXAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-16(7-9-18-10-8-16)15(21)19-13-5-3-12(4-6-13)11-14(20)17-2/h3-6,18H,7-11H2,1-2H3,(H,17,20)(H,19,21).
What are the key properties of 4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide?
4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.30, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-4-carboxamide is sourced from PubChem (CID 63121646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).