N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide

C11H8ClN3O2 — CID 104820977

IUPACN-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide
SMILESO=C(Nc1cc(Cl)ccn1)c1ncccc1O
InChIInChI=1S/C11H8ClN3O2/c12-7-3-5-13-9(6-7)15-11(17)10-8(16)2-1-4-14-10/h1-6,16H,(H,13,15,17)
InChIKeyNHSAYBJCLKBCHY-UHFFFAOYSA-N
MW249.66 g/mol
LogP2.09
Rot. Bonds2

About N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide

N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide (PubChem CID 104820977) has the molecular formula C11H8ClN3O2 and a molecular weight of 249.66 g/mol. Its IUPAC name is N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide
PubChem CID104820977
Molecular FormulaC11H8ClN3O2
Molecular Weight249.66 g/mol
Exact Mass249.03
IUPAC NameN-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide
SMILESO=C(Nc1cc(Cl)ccn1)c1ncccc1O
InChIInChI=1S/C11H8ClN3O2/c12-7-3-5-13-9(6-7)15-11(17)10-8(16)2-1-4-14-10/h1-6,16H,(H,13,15,17)
InChIKeyNHSAYBJCLKBCHY-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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Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide?
The IUPAC name of N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide (CID 104820977) is N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide.
What is the SMILES notation for N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide?
The canonical SMILES for N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide is O=C(Nc1cc(Cl)ccn1)c1ncccc1O.
What is the InChIKey of N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide?
The InChIKey is NHSAYBJCLKBCHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClN3O2/c12-7-3-5-13-9(6-7)15-11(17)10-8(16)2-1-4-14-10/h1-6,16H,(H,13,15,17).
What are the key properties of N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide?
N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide 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 N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide is sourced from PubChem (CID 104820977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).