6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide

C14H10ClN5O — CID 61041740

IUPAC6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1-n1cccn1)c1ccc(Cl)nn1
InChIInChI=1S/C14H10ClN5O/c15-13-7-6-11(18-19-13)14(21)17-10-4-1-2-5-12(10)20-9-3-8-16-20/h1-9H,(H,17,21)
InChIKeyMBLMFBDXNAWTEU-UHFFFAOYSA-N
MW299.72 g/mol
LogP2.57
Rot. Bonds3

About 6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide

6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide (PubChem CID 61041740) has the molecular formula C14H10ClN5O and a molecular weight of 299.72 g/mol. Its IUPAC name is 6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide
PubChem CID61041740
Molecular FormulaC14H10ClN5O
Molecular Weight299.72 g/mol
Exact Mass299.06
IUPAC Name6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1-n1cccn1)c1ccc(Cl)nn1
InChIInChI=1S/C14H10ClN5O/c15-13-7-6-11(18-19-13)14(21)17-10-4-1-2-5-12(10)20-9-3-8-16-20/h1-9H,(H,17,21)
InChIKeyMBLMFBDXNAWTEU-UHFFFAOYSA-N
XLogP2.57
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.72
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide
CID 54927074
6-bromo-N-(2-pyrazol-1-ylphenyl)pyridine-2-carboxamide
CID 103874264
3-bromo-2,6-dichloro-N-(2-pyrazol-1-ylphenyl)benzamide
CID 132992182
4-propan-2-yl-N-(2-pyrazol-1-ylphenyl)benzamide
CID 47045211
6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 61276124
6-chloro-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]pyridazine-3-carboxamide
CID 61217247
6-chloro-N-(2-ethylphenyl)pyridazine-3-carboxamide
CID 60859186
1,1-dimethyl-3-(2-pyrazol-1-ylphenyl)urea
CID 110470431
6-chloro-N-(2-methoxyphenyl)pyridazine-3-carboxamide
CID 60859833
3-methyl-N-(2-pyrazol-1-ylphenyl)but-2-enamide
CID 47234607
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CID 79200496

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide (CID 61041740) is 6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide is O=C(Nc1ccccc1-n1cccn1)c1ccc(Cl)nn1.
What is the InChIKey of 6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide?
The InChIKey is MBLMFBDXNAWTEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN5O/c15-13-7-6-11(18-19-13)14(21)17-10-4-1-2-5-12(10)20-9-3-8-16-20/h1-9H,(H,17,21).
What are the key properties of 6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide?
6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide has a molecular weight of 299.72 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 61041740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).