N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide

C15H12N4O — CID 113200315

IUPACN-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ccc(C3CC3)nn2)cc1
InChIInChI=1S/C15H12N4O/c16-9-10-1-5-12(6-2-10)17-15(20)14-8-7-13(18-19-14)11-3-4-11/h1-2,5-8,11H,3-4H2,(H,17,20)
InChIKeyKHXKCVVLXOQNRX-UHFFFAOYSA-N
MW264.29 g/mol
LogP2.48
Rot. Bonds3

About N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide

N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide (PubChem CID 113200315) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide
PubChem CID113200315
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC NameN-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ccc(C3CC3)nn2)cc1
InChIInChI=1S/C15H12N4O/c16-9-10-1-5-12(6-2-10)17-15(20)14-8-7-13(18-19-14)11-3-4-11/h1-2,5-8,11H,3-4H2,(H,17,20)
InChIKeyKHXKCVVLXOQNRX-UHFFFAOYSA-N
XLogP2.48
TPSA78.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide
CID 113200314
6-cyclopropyl-N-[4-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
CID 113200265
N-(4-cyanophenyl)-6-phenylpyridazine-3-carboxamide
CID 113200694
6-cyclopropyl-N-(4-piperidin-1-ylphenyl)pyridazine-3-carboxamide
CID 113200278
N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109126028
N-(4-cyanophenyl)-6-(prop-2-enylamino)pyridazine-3-carboxamide
CID 109110375
N-(4-chlorophenyl)-5-cyanopyridine-2-carboxamide
CID 63716705
N-(4-carbamoylphenyl)-5-cyanopyridine-2-carboxamide
CID 63718017
6-(3-cyanoanilino)-N-(4-cyanophenyl)pyridazine-3-carboxamide
CID 109130370
N-(4-cyanophenyl)-6-(dipropylamino)pyridazine-3-carboxamide
CID 109126210
N-(4-cyanophenyl)-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide
CID 109124224
5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109199006

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide?
The IUPAC name of N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide (CID 113200315) is N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide.
What is the SMILES notation for N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide?
The canonical SMILES for N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide is N#Cc1ccc(NC(=O)c2ccc(C3CC3)nn2)cc1.
What is the InChIKey of N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide?
The InChIKey is KHXKCVVLXOQNRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O/c16-9-10-1-5-12(6-2-10)17-15(20)14-8-7-13(18-19-14)11-3-4-11/h1-2,5-8,11H,3-4H2,(H,17,20).
What are the key properties of N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide?
N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide has a molecular weight of 264.29 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide is sourced from PubChem (CID 113200315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).