N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide

C12H10ClN3O2 — CID 104954751

IUPACN-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide
SMILESCc1cc(NC(=O)c2ncccc2O)cnc1Cl
InChIInChI=1S/C12H10ClN3O2/c1-7-5-8(6-15-11(7)13)16-12(18)10-9(17)3-2-4-14-10/h2-6,17H,1H3,(H,16,18)
InChIKeyWPLPMPMBMAFFSK-UHFFFAOYSA-N
MW263.68 g/mol
LogP2.40
Rot. Bonds2

About N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide

N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide (PubChem CID 104954751) has the molecular formula C12H10ClN3O2 and a molecular weight of 263.68 g/mol. Its IUPAC name is N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide
PubChem CID104954751
Molecular FormulaC12H10ClN3O2
Molecular Weight263.68 g/mol
Exact Mass263.05
IUPAC NameN-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide
SMILESCc1cc(NC(=O)c2ncccc2O)cnc1Cl
InChIInChI=1S/C12H10ClN3O2/c1-7-5-8(6-15-11(7)13)16-12(18)10-9(17)3-2-4-14-10/h2-6,17H,1H3,(H,16,18)
InChIKeyWPLPMPMBMAFFSK-UHFFFAOYSA-N
XLogP2.40
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.68
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(6-chloro-5-methyl-3-pyridinyl)-2-fluoropyridine-3-carboxamide
CID 107363154
N-(6-chloro-5-methyl-3-pyridinyl)-3-methylbenzamide
CID 103730447
5-chloro-N-(6-chloro-5-methyl-3-pyridinyl)-2-methylbenzamide
CID 103842318
4-bromo-N-(6-chloro-5-methyl-3-pyridinyl)-3-methylbenzamide
CID 114049068
2-bromo-5-chloro-N-(6-chloro-5-methyl-3-pyridinyl)benzamide
CID 103745291
2-bromo-N-(6-chloro-5-methyl-3-pyridinyl)furan-3-carboxamide
CID 107091817
N-(6-chloro-5-methyl-3-pyridinyl)-2-hydroxy-4-methoxybenzamide
CID 103746246
N-(6-chloro-5-methyl-3-pyridinyl)-3-fluoropyridine-4-carboxamide
CID 103745275
2-bromo-N-(6-chloro-5-methyl-3-pyridinyl)-5-fluorobenzamide
CID 113250431
N-(6-chloro-5-methyl-3-pyridinyl)-6-fluoropyridine-3-carboxamide
CID 103745328
5-bromo-N-(6-chloro-5-methyl-3-pyridinyl)-4-methylthiophene-2-carboxamide
CID 103745343
N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide
CID 113253464

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide?
The IUPAC name of N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide (CID 104954751) is N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide.
What is the SMILES notation for N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide?
The canonical SMILES for N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide is Cc1cc(NC(=O)c2ncccc2O)cnc1Cl.
What is the InChIKey of N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide?
The InChIKey is WPLPMPMBMAFFSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN3O2/c1-7-5-8(6-15-11(7)13)16-12(18)10-9(17)3-2-4-14-10/h2-6,17H,1H3,(H,16,18).
What are the key properties of N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide?
N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide has a molecular weight of 263.68 g/mol, XLogP of 2.40, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-5-methyl-3-pyridinyl)-3-hydroxypyridine-2-carboxamide is sourced from PubChem (CID 104954751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).