N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide

C16H23N3O2 — CID 63131670

IUPACN-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide
SMILESCN(CC(=O)Nc1ccccc1)C(=O)C1(C)CCCNC1
InChIInChI=1S/C16H23N3O2/c1-16(9-6-10-17-12-16)15(21)19(2)11-14(20)18-13-7-4-3-5-8-13/h3-5,7-8,17H,6,9-12H2,1-2H3,(H,18,20)
InChIKeyAUBIFQWJRCLWNV-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.47
Rot. Bonds4

About N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide

N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide (PubChem CID 63131670) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide
PubChem CID63131670
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide
SMILESCN(CC(=O)Nc1ccccc1)C(=O)C1(C)CCCNC1
InChIInChI=1S/C16H23N3O2/c1-16(9-6-10-17-12-16)15(21)19(2)11-14(20)18-13-7-4-3-5-8-13/h3-5,7-8,17H,6,9-12H2,1-2H3,(H,18,20)
InChIKeyAUBIFQWJRCLWNV-UHFFFAOYSA-N
XLogP1.47
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,3-dimethyl-N-[2-(methylamino)-2-oxoethyl]piperidine-3-carboxamide
CID 63130187
methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate
CID 63131941
N-[(4-ethylphenyl)methyl]-N,3-dimethylpiperidine-3-carboxamide;hydrochloride
CID 119943770
4-amino-N-(2-anilino-2-oxoethyl)-N-methyloxane-4-carboxamide
CID 115294277
N-[(2-ethoxyphenyl)methyl]-N,3-dimethylpiperidine-3-carboxamide
CID 63131473
N-benzyl-3-methyl-N-propylpiperidine-3-carboxamide
CID 63130370
N-(2-anilino-2-oxoethyl)-N-methyl-2-pyrrolidin-2-ylacetamide
CID 61364850
N,3-dimethyl-N-[(4-propan-2-ylphenyl)methyl]piperidine-3-carboxamide
CID 63131135
3-amino-N-(2-anilino-2-oxoethyl)-N-methyloxolane-3-carboxamide
CID 64892555
N-(2-hydroxy-2-methylpropyl)-N,3-dimethylpiperidine-3-carboxamide
CID 79377525
1-hydroxy-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopentane-1-carboxamide
CID 110890174
N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide
CID 113397758

Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide?
The IUPAC name of N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide (CID 63131670) is N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide?
The canonical SMILES for N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide is CN(CC(=O)Nc1ccccc1)C(=O)C1(C)CCCNC1.
What is the InChIKey of N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide?
The InChIKey is AUBIFQWJRCLWNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-16(9-6-10-17-12-16)15(21)19(2)11-14(20)18-13-7-4-3-5-8-13/h3-5,7-8,17H,6,9-12H2,1-2H3,(H,18,20).
What are the key properties of N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide?
N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide is sourced from PubChem (CID 63131670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).