2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide

C11H8ClN3O2 — CID 106501440

IUPAC2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide
SMILESO=C(Nc1cnccn1)c1cc(O)ccc1Cl
InChIInChI=1S/C11H8ClN3O2/c12-9-2-1-7(16)5-8(9)11(17)15-10-6-13-3-4-14-10/h1-6,16H,(H,14,15,17)
InChIKeySIXUQWQBFUDSID-UHFFFAOYSA-N
MW249.66 g/mol
LogP2.09
Rot. Bonds2

About 2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide

2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide (PubChem CID 106501440) has the molecular formula C11H8ClN3O2 and a molecular weight of 249.66 g/mol. Its IUPAC name is 2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide.

Molecular Properties

Compound Name2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide
PubChem CID106501440
Molecular FormulaC11H8ClN3O2
Molecular Weight249.66 g/mol
Exact Mass249.03
IUPAC Name2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide
SMILESO=C(Nc1cnccn1)c1cc(O)ccc1Cl
InChIInChI=1S/C11H8ClN3O2/c12-9-2-1-7(16)5-8(9)11(17)15-10-6-13-3-4-14-10/h1-6,16H,(H,14,15,17)
InChIKeySIXUQWQBFUDSID-UHFFFAOYSA-N
XLogP2.09
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.66
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-N-pyrazin-2-ylbenzamide
CID 43422735
2-chloro-5-hydroxy-N-pyridin-3-ylbenzamide
CID 106501191
N-(3-amino-4-pyridinyl)-2-chloro-5-hydroxybenzamide
CID 106500113
2-amino-4-chloro-N-pyrazin-2-ylbenzamide
CID 43616024
2-bromo-4-chloro-N-pyrazin-2-ylbenzamide
CID 104853699
2-chloro-N-pyrazin-2-yl-4-(trifluoromethyl)benzamide
CID 75508828
3,5-dihydroxy-N-pyrazin-2-ylbenzamide
CID 107703696
2-chloro-5-hydroxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 106501199
2-bromo-N-pyrazin-2-ylbenzamide
CID 43409356
2-[(2-chloro-5-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
CID 106500292
2-chloro-5-hydroxy-N-(6-methyl-3-pyridinyl)benzamide
CID 106502027
4-chloro-3-(4-phenylphenyl)-N-pyrazin-2-ylbenzamide
CID 11523880

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide?
The IUPAC name of 2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide (CID 106501440) is 2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide.
What is the SMILES notation for 2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide?
The canonical SMILES for 2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide is O=C(Nc1cnccn1)c1cc(O)ccc1Cl.
What is the InChIKey of 2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide?
The InChIKey is SIXUQWQBFUDSID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClN3O2/c12-9-2-1-7(16)5-8(9)11(17)15-10-6-13-3-4-14-10/h1-6,16H,(H,14,15,17).
What are the key properties of 2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide?
2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide has a molecular weight of 249.66 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-hydroxy-N-pyrazin-2-ylbenzamide is sourced from PubChem (CID 106501440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).