5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide

C11H9ClN4O — CID 107585014

IUPAC5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide
SMILESCc1cncc(NC(=O)c2cnc(Cl)cn2)c1
InChIInChI=1S/C11H9ClN4O/c1-7-2-8(4-13-3-7)16-11(17)9-5-15-10(12)6-14-9/h2-6H,1H3,(H,16,17)
InChIKeyHAECVYUUGCWKLM-UHFFFAOYSA-N
MW248.67 g/mol
LogP2.09
Rot. Bonds2

About 5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide

5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide (PubChem CID 107585014) has the molecular formula C11H9ClN4O and a molecular weight of 248.67 g/mol. Its IUPAC name is 5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide
PubChem CID107585014
Molecular FormulaC11H9ClN4O
Molecular Weight248.67 g/mol
Exact Mass248.05
IUPAC Name5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide
SMILESCc1cncc(NC(=O)c2cnc(Cl)cn2)c1
InChIInChI=1S/C11H9ClN4O/c1-7-2-8(4-13-3-7)16-11(17)9-5-15-10(12)6-14-9/h2-6H,1H3,(H,16,17)
InChIKeyHAECVYUUGCWKLM-UHFFFAOYSA-N
XLogP2.09
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.67
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide
CID 107586715
5-chloro-N-(3,5-dichloro-4-fluorophenyl)pyrazine-2-carboxamide
CID 107573378
2-chloro-N-(5-methyl-3-pyridinyl)pyridine-3-carboxamide
CID 103738978
5-[(5-chloropyrazine-2-carbonyl)amino]-2-methylbenzoic acid
CID 107371536
4-methyl-N-(5-methyl-3-pyridinyl)benzamide
CID 110727246
N-(3-bromo-4-methoxyphenyl)-5-chloropyrazine-2-carboxamide
CID 113265025
propan-2-yl N-(5-methyl-3-pyridinyl)carbamate
CID 107584983
N-[4-(carbamoylamino)phenyl]-5-chloropyrazine-2-carboxamide
CID 103817085
1-chloro-N-(5-methyl-3-pyridinyl)isoquinoline-4-carboxamide
CID 106831970
5-chloro-N-[4-chloro-3-(methylcarbamoyl)phenyl]pyrazine-2-carboxamide
CID 103817189
2-chloro-N-(5-methyl-3-pyridinyl)-5-sulfanylbenzamide
CID 107587050
5-[(5-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid
CID 107371641

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide?
The IUPAC name of 5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide (CID 107585014) is 5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide is Cc1cncc(NC(=O)c2cnc(Cl)cn2)c1.
What is the InChIKey of 5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide?
The InChIKey is HAECVYUUGCWKLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN4O/c1-7-2-8(4-13-3-7)16-11(17)9-5-15-10(12)6-14-9/h2-6H,1H3,(H,16,17).
What are the key properties of 5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide?
5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide has a molecular weight of 248.67 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide is sourced from PubChem (CID 107585014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).