(2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide

C15H21N3O2 — CID 40987938

IUPAC(2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide
SMILESCc1cccc(NC(=O)CN2CCCC[C@@H]2C(N)=O)c1
InChIInChI=1S/C15H21N3O2/c1-11-5-4-6-12(9-11)17-14(19)10-18-8-3-2-7-13(18)15(16)20/h4-6,9,13H,2-3,7-8,10H2,1H3,(H2,16,20)(H,17,19)/t13-/m1/s1
InChIKeyRPQAWGAAYYWOKN-CYBMUJFWSA-N
MW275.35 g/mol
LogP1.27
Rot. Bonds4

About (2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide

(2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide (PubChem CID 40987938) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is (2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide
PubChem CID40987938
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name(2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide
SMILESCc1cccc(NC(=O)CN2CCCC[C@@H]2C(N)=O)c1
InChIInChI=1S/C15H21N3O2/c1-11-5-4-6-12(9-11)17-14(19)10-18-8-3-2-7-13(18)15(16)20/h4-6,9,13H,2-3,7-8,10H2,1H3,(H2,16,20)(H,17,19)/t13-/m1/s1
InChIKeyRPQAWGAAYYWOKN-CYBMUJFWSA-N
XLogP1.27
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-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

(2S)-1-[2-(3,4-dimethylanilino)-2-oxoethyl]piperidine-2-carboxamide
CID 41096237
2-[(2S)-2-ethylpiperidin-1-yl]-N-(3-methylphenyl)acetamide
CID 129380241
(2S)-1-[2-(3-methyl-4-pyrrolidin-1-ylanilino)-2-oxoethyl]piperidine-2-carboxamide
CID 40792929
(2R)-1-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]piperidine-2-carboxamide
CID 41292691
2-(azocan-1-yl)-N-(3-methylphenyl)acetamide
CID 2655272
(2S)-1-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]piperidine-2-carboxamide
CID 40918330
N-(3-acetylphenyl)-2-[(2S)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 52518463
1-(2-anilino-2-oxoethyl)piperidine-2-carboxylic acid
CID 43441072
2-[2-(aminomethyl)-3-methylpyrrolidin-1-yl]-N-(3-methylphenyl)acetamide
CID 102784771
(2R)-1-[2-(4-chloroanilino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 9405076
(2R)-1-[(3-methylphenyl)carbamothioyl]pyrrolidine-2-carboxamide
CID 8680082
(2S)-1-[2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl]piperidine-2-carboxamide
CID 25444668

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide?
The IUPAC name of (2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide (CID 40987938) is (2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide.
What is the SMILES notation for (2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide?
The canonical SMILES for (2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide is Cc1cccc(NC(=O)CN2CCCC[C@@H]2C(N)=O)c1.
What is the InChIKey of (2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide?
The InChIKey is RPQAWGAAYYWOKN-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11-5-4-6-12(9-11)17-14(19)10-18-8-3-2-7-13(18)15(16)20/h4-6,9,13H,2-3,7-8,10H2,1H3,(H2,16,20)(H,17,19)/t13-/m1/s1.
What are the key properties of (2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide?
(2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide is sourced from PubChem (CID 40987938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).