N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide

C20H18N4O2 — CID 95618514

IUPACN-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide
SMILESCN(C(=O)c1cnc2ccccc2n1)[C@@H]1CCN(c2ccccc2)C1=O
InChIInChI=1S/C20H18N4O2/c1-23(18-11-12-24(20(18)26)14-7-3-2-4-8-14)19(25)17-13-21-15-9-5-6-10-16(15)22-17/h2-10,13,18H,11-12H2,1H3/t18-/m1/s1
InChIKeyASMARMWZNWXWLY-GOSISDBHSA-N
MW346.39 g/mol
LogP2.51
Rot. Bonds3

About N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide

N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide (PubChem CID 95618514) has the molecular formula C20H18N4O2 and a molecular weight of 346.39 g/mol. Its IUPAC name is N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide
PubChem CID95618514
Molecular FormulaC20H18N4O2
Molecular Weight346.39 g/mol
Exact Mass346.14
IUPAC NameN-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide
SMILESCN(C(=O)c1cnc2ccccc2n1)[C@@H]1CCN(c2ccccc2)C1=O
InChIInChI=1S/C20H18N4O2/c1-23(18-11-12-24(20(18)26)14-7-3-2-4-8-14)19(25)17-13-21-15-9-5-6-10-16(15)22-17/h2-10,13,18H,11-12H2,1H3/t18-/m1/s1
InChIKeyASMARMWZNWXWLY-GOSISDBHSA-N
XLogP2.51
TPSA66.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-6-methylsulfanyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]pyridine-3-carboxamide
CID 96515543
2-methoxy-N-methyl-N-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 95303783
N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119776444
1-[2-[methyl-(2-oxo-1-phenylpyrrolidin-3-yl)amino]-2-oxoethyl]pyrazole-4-carboxylic acid
CID 146136932
3-amino-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide;hydrochloride
CID 119319399
N-methyl-2-(methylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)acetamide
CID 119776453
1-methyl-1-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]-3-pyridin-4-ylurea
CID 95980251
5-amino-N,2-dimethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide;hydrochloride
CID 120631203
N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]-1,3-benzodioxole-4-carboxamide
CID 95621378
N-[(3aR,6aS)-5-(dimethylamino)-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]-N-methylquinoxaline-2-carboxamide
CID 134696118
3-(2,6-dimethylphenyl)-1-methyl-1-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]urea
CID 95630430
3-[methyl-(2-oxo-1-phenylpyrrolidin-3-yl)amino]propanoic acid
CID 119958678

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide?
The IUPAC name of N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide (CID 95618514) is N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide.
What is the SMILES notation for N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide?
The canonical SMILES for N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide is CN(C(=O)c1cnc2ccccc2n1)[C@@H]1CCN(c2ccccc2)C1=O.
What is the InChIKey of N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide?
The InChIKey is ASMARMWZNWXWLY-GOSISDBHSA-N. The full InChI is InChI=1S/C20H18N4O2/c1-23(18-11-12-24(20(18)26)14-7-3-2-4-8-14)19(25)17-13-21-15-9-5-6-10-16(15)22-17/h2-10,13,18H,11-12H2,1H3/t18-/m1/s1.
What are the key properties of N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide?
N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide has a molecular weight of 346.39 g/mol, XLogP of 2.51, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide is sourced from PubChem (CID 95618514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).