N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide

C16H16N4O2 — CID 42140131

IUPACN-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide
SMILESCc1cc(NC(=O)c2cnccn2)ccc1N1CCCC1=O
InChIInChI=1S/C16H16N4O2/c1-11-9-12(19-16(22)13-10-17-6-7-18-13)4-5-14(11)20-8-2-3-15(20)21/h4-7,9-10H,2-3,8H2,1H3,(H,19,22)
InChIKeyCGCRAVCLOGXGRQ-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.16
Rot. Bonds3

About N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide

N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide (PubChem CID 42140131) has the molecular formula C16H16N4O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide
PubChem CID42140131
Molecular FormulaC16H16N4O2
Molecular Weight296.33 g/mol
Exact Mass296.13
IUPAC NameN-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide
SMILESCc1cc(NC(=O)c2cnccn2)ccc1N1CCCC1=O
InChIInChI=1S/C16H16N4O2/c1-11-9-12(19-16(22)13-10-17-6-7-18-13)4-5-14(11)20-8-2-3-15(20)21/h4-7,9-10H,2-3,8H2,1H3,(H,19,22)
InChIKeyCGCRAVCLOGXGRQ-UHFFFAOYSA-N
XLogP2.16
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]benzoic acid
CID 45393767
2,5-dimethyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 42140184
2-chloro-3-methyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 131946801
N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(2-oxopiperidin-1-yl)benzamide
CID 18204867
2,3-dimethyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 42140218
2-bromo-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686588
5-chloro-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pentanamide
CID 43347098
N'-(3,5-dimethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 30679282
N-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrazine-2-carboxamide
CID 110792487
N-(4-bromo-3-methylphenyl)pyrazine-2-carboxamide
CID 3273013
6-(3,5-dimethylpyrazol-1-yl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyridine-3-carboxamide
CID 43069243
phenyl N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]carbamate
CID 7686624

Frequently Asked Questions

What is the IUPAC name of N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide?
The IUPAC name of N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide (CID 42140131) is N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide is Cc1cc(NC(=O)c2cnccn2)ccc1N1CCCC1=O.
What is the InChIKey of N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide?
The InChIKey is CGCRAVCLOGXGRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2/c1-11-9-12(19-16(22)13-10-17-6-7-18-13)4-5-14(11)20-8-2-3-15(20)21/h4-7,9-10H,2-3,8H2,1H3,(H,19,22).
What are the key properties of N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide?
N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide has a molecular weight of 296.33 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide is sourced from PubChem (CID 42140131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).