4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide

C12H10ClN3O2 — CID 112739518

IUPAC4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide
SMILESCOc1cc(NC(=O)c2cnccc2Cl)ccn1
InChIInChI=1S/C12H10ClN3O2/c1-18-11-6-8(2-5-15-11)16-12(17)9-7-14-4-3-10(9)13/h2-7H,1H3,(H,15,16,17)
InChIKeyLWQXNCGTTLXAIO-UHFFFAOYSA-N
MW263.68 g/mol
LogP2.39
Rot. Bonds3

About 4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide

4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide (PubChem CID 112739518) has the molecular formula C12H10ClN3O2 and a molecular weight of 263.68 g/mol. Its IUPAC name is 4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide
PubChem CID112739518
Molecular FormulaC12H10ClN3O2
Molecular Weight263.68 g/mol
Exact Mass263.05
IUPAC Name4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide
SMILESCOc1cc(NC(=O)c2cnccc2Cl)ccn1
InChIInChI=1S/C12H10ClN3O2/c1-18-11-6-8(2-5-15-11)16-12(17)9-7-14-4-3-10(9)13/h2-7H,1H3,(H,15,16,17)
InChIKeyLWQXNCGTTLXAIO-UHFFFAOYSA-N
XLogP2.39
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.68
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-4-chloro-N-(2-methoxy-4-pyridinyl)benzamide
CID 112739552
4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide
CID 81227052
4-chloro-N-[6-(2-methoxyethoxy)-3-pyridinyl]pyridine-3-carboxamide
CID 81228254
4-chloro-N-(6-ethoxy-3-pyridinyl)pyridine-3-carboxamide
CID 81233280
4-chloro-N-[3-(methoxymethyl)phenyl]pyridine-3-carboxamide
CID 81227235
4-chloro-N-(3-chlorophenyl)pyridine-3-carboxamide
CID 81225135
4-chloro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide
CID 107701234
4-chloro-N-(3-chloro-4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 81230238
4-chloro-N-methoxypyridine-3-carboxamide
CID 103871256
N-(4-carbamoyl-3-chlorophenyl)-4-chloropyridine-3-carboxamide
CID 81226788
2-methoxy-N-pyridin-3-ylpyridine-4-carboxamide
CID 84580431
3-chloro-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 66462058

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide (CID 112739518) is 4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide is COc1cc(NC(=O)c2cnccc2Cl)ccn1.
What is the InChIKey of 4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide?
The InChIKey is LWQXNCGTTLXAIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN3O2/c1-18-11-6-8(2-5-15-11)16-12(17)9-7-14-4-3-10(9)13/h2-7H,1H3,(H,15,16,17).
What are the key properties of 4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide?
4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide has a molecular weight of 263.68 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 112739518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).