6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide

C13H9ClN4O — CID 103186986

IUPAC6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide
SMILESO=C(Nc1ccc2[nH]ccc2c1)c1cncc(Cl)n1
InChIInChI=1S/C13H9ClN4O/c14-12-7-15-6-11(18-12)13(19)17-9-1-2-10-8(5-9)3-4-16-10/h1-7,16H,(H,17,19)
InChIKeyAXSOOQCLOLHAEU-UHFFFAOYSA-N
MW272.70 g/mol
LogP2.86
Rot. Bonds2

About 6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide

6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide (PubChem CID 103186986) has the molecular formula C13H9ClN4O and a molecular weight of 272.70 g/mol. Its IUPAC name is 6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide
PubChem CID103186986
Molecular FormulaC13H9ClN4O
Molecular Weight272.70 g/mol
Exact Mass272.05
IUPAC Name6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide
SMILESO=C(Nc1ccc2[nH]ccc2c1)c1cncc(Cl)n1
InChIInChI=1S/C13H9ClN4O/c14-12-7-15-6-11(18-12)13(19)17-9-1-2-10-8(5-9)3-4-16-10/h1-7,16H,(H,17,19)
InChIKeyAXSOOQCLOLHAEU-UHFFFAOYSA-N
XLogP2.86
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.70
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-indol-5-yl)pyrazine-2-carboxamide
CID 110744977
6-chloro-N-(1H-indol-5-yl)pyridazine-3-carboxamide
CID 61250320
3,5-dichloro-N-(1H-indol-5-yl)benzamide
CID 171571909
N-(1H-indol-5-yl)-1,3-thiazole-4-carboxamide
CID 63050132
2,4-dichloro-N-(1H-indol-5-yl)benzamide
CID 171571914
6-chloro-N-(6-chloro-3-pyridinyl)pyrazine-2-carboxamide
CID 103186985
2-amino-4-chloro-N-(1H-indol-5-yl)benzamide
CID 63110093
2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide
CID 103763682
N-(1H-indol-5-yl)prop-2-enamide
CID 61251524
6-chloro-N-(3-iodophenyl)pyrazine-2-carboxamide
CID 103336801
N-(1H-indol-5-yl)-1-methylpyrazole-4-carboxamide
CID 110471413
N-(1H-indol-5-yl)imidazo[1,5-a]pyridine-7-carboxamide
CID 112526019

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide?
The IUPAC name of 6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide (CID 103186986) is 6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide?
The canonical SMILES for 6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide is O=C(Nc1ccc2[nH]ccc2c1)c1cncc(Cl)n1.
What is the InChIKey of 6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide?
The InChIKey is AXSOOQCLOLHAEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClN4O/c14-12-7-15-6-11(18-12)13(19)17-9-1-2-10-8(5-9)3-4-16-10/h1-7,16H,(H,17,19).
What are the key properties of 6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide?
6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide has a molecular weight of 272.70 g/mol, XLogP of 2.86, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 103186986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).