(2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide

C19H19N3O4 — CID 46997763

IUPAC(2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide
SMILESCOc1ccccc1C(=O)Nc1cccc(NC(=O)[C@@H]2CCC(=O)N2)c1
InChIInChI=1S/C19H19N3O4/c1-26-16-8-3-2-7-14(16)18(24)20-12-5-4-6-13(11-12)21-19(25)15-9-10-17(23)22-15/h2-8,11,15H,9-10H2,1H3,(H,20,24)(H,21,25)(H,22,23)/t15-/m0/s1
InChIKeyXUITZZKTBLLCDS-HNNXBMFYSA-N
MW353.38 g/mol
LogP2.16
Rot. Bonds5

About (2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide

(2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide (PubChem CID 46997763) has the molecular formula C19H19N3O4 and a molecular weight of 353.38 g/mol. Its IUPAC name is (2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide
PubChem CID46997763
Molecular FormulaC19H19N3O4
Molecular Weight353.38 g/mol
Exact Mass353.14
IUPAC Name(2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide
SMILESCOc1ccccc1C(=O)Nc1cccc(NC(=O)[C@@H]2CCC(=O)N2)c1
InChIInChI=1S/C19H19N3O4/c1-26-16-8-3-2-7-14(16)18(24)20-12-5-4-6-13(11-12)21-19(25)15-9-10-17(23)22-15/h2-8,11,15H,9-10H2,1H3,(H,20,24)(H,21,25)(H,22,23)/t15-/m0/s1
InChIKeyXUITZZKTBLLCDS-HNNXBMFYSA-N
XLogP2.16
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 52.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(cyclopentanecarbonylamino)phenyl]-2-methoxybenzamide
CID 46880084
N-[3-(cyclohexanecarbonylamino)phenyl]-2-methoxybenzamide
CID 46880083
N-(4-methoxy-3-methylphenyl)-5-oxopyrrolidine-2-carboxamide
CID 110792509
N-[4-(2-methoxyphenoxy)phenyl]-5-oxopyrrolidine-2-carboxamide
CID 42889996
N-(3-aminophenyl)-5-oxopyrrolidine-2-carboxamide
CID 110482254
5-oxo-N-(3,4,5-trimethoxyphenyl)pyrrolidine-2-carboxamide
CID 110689736
(2S)-N-(3-amino-4-methoxyphenyl)-5-oxopyrrolidine-2-carboxamide;hydrochloride
CID 119420078
N-[(4S)-4-cyclopropyl-2-oxo-3,4-dihydro-1H-quinolin-7-yl]-2-methoxybenzamide
CID 95125652
N-(3-methylsulfonylphenyl)-5-oxopyrrolidine-2-carboxamide
CID 110793299
2-methoxy-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide
CID 108933228
2-methoxy-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
CID 38397232
ethyl 3-[(5-oxopyrrolidine-2-carbonyl)amino]benzoate
CID 110462157

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of (2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide (CID 46997763) is (2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide is COc1ccccc1C(=O)Nc1cccc(NC(=O)[C@@H]2CCC(=O)N2)c1.
What is the InChIKey of (2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide?
The InChIKey is XUITZZKTBLLCDS-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H19N3O4/c1-26-16-8-3-2-7-14(16)18(24)20-12-5-4-6-13(11-12)21-19(25)15-9-10-17(23)22-15/h2-8,11,15H,9-10H2,1H3,(H,20,24)(H,21,25)(H,22,23)/t15-/m0/s1.
What are the key properties of (2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide?
(2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide has a molecular weight of 353.38 g/mol, XLogP of 2.16, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[3-[(2-methoxybenzoyl)amino]phenyl]-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 46997763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).