4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide

C10H7ClN4O — CID 115635761

IUPAC4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide
SMILESO=C(Nc1cccnn1)c1cc(Cl)ccn1
InChIInChI=1S/C10H7ClN4O/c11-7-3-5-12-8(6-7)10(16)14-9-2-1-4-13-15-9/h1-6H,(H,14,15,16)
InChIKeyKTIXRALHZOKZNJ-UHFFFAOYSA-N
MW234.65 g/mol
LogP1.78
Rot. Bonds2

About 4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide

4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide (PubChem CID 115635761) has the molecular formula C10H7ClN4O and a molecular weight of 234.65 g/mol. Its IUPAC name is 4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide
PubChem CID115635761
Molecular FormulaC10H7ClN4O
Molecular Weight234.65 g/mol
Exact Mass234.03
IUPAC Name4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide
SMILESO=C(Nc1cccnn1)c1cc(Cl)ccn1
InChIInChI=1S/C10H7ClN4O/c11-7-3-5-12-8(6-7)10(16)14-9-2-1-4-13-15-9/h1-6H,(H,14,15,16)
InChIKeyKTIXRALHZOKZNJ-UHFFFAOYSA-N
XLogP1.78
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.65
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-[2-[(4-chloropyridine-2-carbonyl)amino]phenyl]pyridine-2-carboxamide
CID 102274363
2-bromo-4-chloro-N-pyridazin-3-ylbenzamide
CID 103765308
4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide
CID 45497358
3-[(4-chloropyridine-2-carbonyl)amino]pyridine-2-carboxylic acid
CID 104740156
4-chloro-N-hydroxypyridine-2-carboxamide
CID 83381234
4-chloro-N-(2-hydroxyphenyl)pyridine-2-carboxamide
CID 35852171
N-(5-bromo-2-pyridinyl)-4-chloropyridine-2-carboxamide
CID 43111935
3,4,5-trifluoro-N-pyridazin-3-ylbenzamide
CID 113238408
2-amino-N-pyridazin-3-yl-1,3-thiazole-4-carboxamide
CID 116786705
5-amino-2-chloro-N-pyridazin-3-ylbenzamide
CID 116786031
5-bromo-2-chloro-N-pyridazin-3-ylpyridine-3-carboxamide
CID 115635717
(4-chloropyridine-2-carbonyl)carbamic acid
CID 174620541

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide?
The IUPAC name of 4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide (CID 115635761) is 4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide.
What is the SMILES notation for 4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide?
The canonical SMILES for 4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide is O=C(Nc1cccnn1)c1cc(Cl)ccn1.
What is the InChIKey of 4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide?
The InChIKey is KTIXRALHZOKZNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClN4O/c11-7-3-5-12-8(6-7)10(16)14-9-2-1-4-13-15-9/h1-6H,(H,14,15,16).
What are the key properties of 4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide?
4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide has a molecular weight of 234.65 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide is sourced from PubChem (CID 115635761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).