4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide

C17H14N4O — CID 167955003

IUPAC4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide
SMILESCc1ccncc1C(=O)Nc1ccc(-c2ccccc2)nn1
InChIInChI=1S/C17H14N4O/c1-12-9-10-18-11-14(12)17(22)19-16-8-7-15(20-21-16)13-5-3-2-4-6-13/h2-11H,1H3,(H,19,21,22)
InChIKeyMLKRDWBEUPOAPA-UHFFFAOYSA-N
MW290.33 g/mol
LogP3.10
Rot. Bonds3

About 4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide

4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide (PubChem CID 167955003) has the molecular formula C17H14N4O and a molecular weight of 290.33 g/mol. Its IUPAC name is 4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide
PubChem CID167955003
Molecular FormulaC17H14N4O
Molecular Weight290.33 g/mol
Exact Mass290.12
IUPAC Name4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide
SMILESCc1ccncc1C(=O)Nc1ccc(-c2ccccc2)nn1
InChIInChI=1S/C17H14N4O/c1-12-9-10-18-11-14(12)17(22)19-16-8-7-15(20-21-16)13-5-3-2-4-6-13/h2-11H,1H3,(H,19,21,22)
InChIKeyMLKRDWBEUPOAPA-UHFFFAOYSA-N
XLogP3.10
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-dimethyl-N-(6-phenylpyridazin-3-yl)-1,3-oxazole-5-carboxamide
CID 71920781
N,4-diphenylpyridine-3-carboxamide
CID 13115140
ethyl N-(6-phenylpyridazin-3-yl)carbamate
CID 59867445
4-methyl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 166192549
1-[2-(dimethylamino)ethyl]-3-(6-phenylpyridazin-3-yl)-1-propan-2-ylurea
CID 75452753
2-hydroxy-N-(4-methyl-3-pyridinyl)benzamide
CID 63327806
3-phenyl-6-pyridin-3-ylpyridazine
CID 12712239
2-[(6-pyridin-3-ylpyridazin-3-yl)amino]propanoic acid
CID 116971458
4-methyl-N-(2,3,4-trifluorophenyl)pyridine-3-carboxamide
CID 110865121
N-(6-phenylpyridazin-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 122143388
2-(2,7-dimethyl-1,3-dioxoisoindol-4-yl)-N-(6-phenylpyridazin-3-yl)acetamide
CID 118567309
2-methyl-N-[6-(1-phenylethylamino)pyridazin-3-yl]benzamide
CID 113041168

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide?
The IUPAC name of 4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide (CID 167955003) is 4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide is Cc1ccncc1C(=O)Nc1ccc(-c2ccccc2)nn1.
What is the InChIKey of 4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide?
The InChIKey is MLKRDWBEUPOAPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O/c1-12-9-10-18-11-14(12)17(22)19-16-8-7-15(20-21-16)13-5-3-2-4-6-13/h2-11H,1H3,(H,19,21,22).
What are the key properties of 4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide?
4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide has a molecular weight of 290.33 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(6-phenylpyridazin-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 167955003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).