N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide

C17H18N4O3 — CID 69442634

IUPACN-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide
SMILESCN1CC(NC(=O)c2ccc(-n3ccccc3=O)cc2)C(N)C1=O
InChIInChI=1S/C17H18N4O3/c1-20-10-13(15(18)17(20)24)19-16(23)11-5-7-12(8-6-11)21-9-3-2-4-14(21)22/h2-9,13,15H,10,18H2,1H3,(H,19,23)
InChIKeySXMKSMMPAZXIPO-UHFFFAOYSA-N
MW326.36 g/mol
LogP-0.26
Rot. Bonds3

About N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide

N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide (PubChem CID 69442634) has the molecular formula C17H18N4O3 and a molecular weight of 326.36 g/mol. Its IUPAC name is N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide.

Molecular Properties

Compound NameN-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide
PubChem CID69442634
Molecular FormulaC17H18N4O3
Molecular Weight326.36 g/mol
Exact Mass326.14
IUPAC NameN-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide
SMILESCN1CC(NC(=O)c2ccc(-n3ccccc3=O)cc2)C(N)C1=O
InChIInChI=1S/C17H18N4O3/c1-20-10-13(15(18)17(20)24)19-16(23)11-5-7-12(8-6-11)21-9-3-2-4-14(21)22/h2-9,13,15H,10,18H2,1H3,(H,19,23)
InChIKeySXMKSMMPAZXIPO-UHFFFAOYSA-N
XLogP-0.26
TPSA97.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3S,4R)-4-amino-1-(cyclopropanecarbonyl)piperidin-3-yl]-4-(2-oxo-1-pyridinyl)benzamide
CID 58845419
N-[2-[(4-chlorobenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide
CID 75027304
N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide
CID 163680968
tert-butyl (3R,4S)-4-amino-3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]piperidine-1-carboxylate
CID 69437324
N-(2-amino-2,3-dihydro-1H-inden-1-yl)-4-(2-oxo-1-pyridinyl)benzamide
CID 69173385
3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidine-1-carboxamide
CID 18452994
tert-butyl N-[(1S)-2-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]cyclopentyl]carbamate
CID 142943619
N-[(3R)-1-acetyl-4-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]pyrrolidin-3-yl]-5-chlorothiophene-2-carboxamide
CID 58845319
4-chloro-2-methyl-N-[(1R)-2-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]cyclopentyl]benzamide
CID 142943661
1-(3-hydroxy-2,2-dimethylpropanoyl)-3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]piperidine-2-carboxamide
CID 173142948
4-chloro-3-fluoro-N-[(2S)-2-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]cyclopentyl]benzamide
CID 71189210
benzyl N-[(3S,4R)-3-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]piperidin-4-yl]carbamate
CID 69146545

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide?
The IUPAC name of N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide (CID 69442634) is N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide.
What is the SMILES notation for N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide?
The canonical SMILES for N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide is CN1CC(NC(=O)c2ccc(-n3ccccc3=O)cc2)C(N)C1=O.
What is the InChIKey of N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide?
The InChIKey is SXMKSMMPAZXIPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O3/c1-20-10-13(15(18)17(20)24)19-16(23)11-5-7-12(8-6-11)21-9-3-2-4-14(21)22/h2-9,13,15H,10,18H2,1H3,(H,19,23).
What are the key properties of N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide?
N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide has a molecular weight of 326.36 g/mol, XLogP of -0.26, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide is sourced from PubChem (CID 69442634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).