4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide

C20H24N4O — CID 157444833

IUPAC4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCc1ccc(C2=CCN(C(=O)Nc3ccc(C(C)C)cc3)CC2)nn1
InChIInChI=1S/C20H24N4O/c1-14(2)16-5-7-18(8-6-16)21-20(25)24-12-10-17(11-13-24)19-9-4-15(3)22-23-19/h4-10,14H,11-13H2,1-3H3,(H,21,25)
InChIKeyGQDJAGGKIYPXQY-UHFFFAOYSA-N
MW336.44 g/mol
LogP4.23
Rot. Bonds3

About 4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide

4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide (PubChem CID 157444833) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is 4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide.

Molecular Properties

Compound Name4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
PubChem CID157444833
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC Name4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCc1ccc(C2=CCN(C(=O)Nc3ccc(C(C)C)cc3)CC2)nn1
InChIInChI=1S/C20H24N4O/c1-14(2)16-5-7-18(8-6-16)21-20(25)24-12-10-17(11-13-24)19-9-4-15(3)22-23-19/h4-10,14H,11-13H2,1-3H3,(H,21,25)
InChIKeyGQDJAGGKIYPXQY-UHFFFAOYSA-N
XLogP4.23
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(6-cyanopyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
CID 139548032
[1-[(4-propan-2-ylphenyl)carbamoyl]-3,6-dihydro-2H-pyridin-4-yl] trifluoromethanesulfonate
CID 59427385
7-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-2,7-diazaspiro[4.4]nonane-2-carboxamide
CID 159999194
N-[(3S,4R)-4-amino-1-(6-methylpyridazin-3-yl)pyrrolidin-3-yl]-2-(4-propan-2-ylphenyl)acetamide;N-[(3S,4R)-4-(dimethylamino)-1-(6-methylpyridazin-3-yl)pyrrolidin-3-yl]-2-(4-propan-2-ylphenyl)acetamide;4-hydroxy-4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)piperidine-1-carboxamide;N-[(3R,4S)-4-(methylamino)-1-(6-methylpyridazin-3-yl)pyrrolidin-3-yl]-2-(4-propan-2-ylphenyl)acetamide;N-[(3S,4R)-4-(methylamino)-1-(6-methylpyridazin-3-yl)pyrrolidin-3-yl]-2-(4-propan-2-ylphenyl)acetamide;1-[1-(6-methylpyridazin-3-yl)azetidin-3-yl]-3-(4-propan-2-ylphenyl)urea;4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
CID 158954963
N-(4-methylphenyl)-4-(4-propan-2-ylphenyl)piperazine-1-carboxamide
CID 113111349
(2S,6R)-2,6-dimethyl-4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide
CID 157444839
(2S)-2-methyl-4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide
CID 157444836
4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
CID 17416490
(3R)-3-hydroxy-N-(4-propan-2-ylphenyl)pyrrolidine-1-carboxamide
CID 111430995
N-(4-propylphenyl)-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 11301714
4-cyclopropylidene-N-(4-methylphenyl)piperidine-1-carboxamide
CID 121187165
N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 11348741

Frequently Asked Questions

What is the IUPAC name of 4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The IUPAC name of 4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide (CID 157444833) is 4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide.
What is the SMILES notation for 4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The canonical SMILES for 4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide is Cc1ccc(C2=CCN(C(=O)Nc3ccc(C(C)C)cc3)CC2)nn1.
What is the InChIKey of 4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The InChIKey is GQDJAGGKIYPXQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c1-14(2)16-5-7-18(8-6-16)21-20(25)24-12-10-17(11-13-24)19-9-4-15(3)22-23-19/h4-10,14H,11-13H2,1-3H3,(H,21,25).
What are the key properties of 4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide?
4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide has a molecular weight of 336.44 g/mol, XLogP of 4.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 157444833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).