N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide

C15H17N3O — CID 113200408

IUPACN-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide
SMILESCC(C)c1ccc(C(=O)N(C)c2ccccc2)nn1
InChIInChI=1S/C15H17N3O/c1-11(2)13-9-10-14(17-16-13)15(19)18(3)12-7-5-4-6-8-12/h4-11H,1-3H3
InChIKeyZSJYSIZYJPKJLU-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.88
Rot. Bonds3

About N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide

N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide (PubChem CID 113200408) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide
PubChem CID113200408
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide
SMILESCC(C)c1ccc(C(=O)N(C)c2ccccc2)nn1
InChIInChI=1S/C15H17N3O/c1-11(2)13-9-10-14(17-16-13)15(19)18(3)12-7-5-4-6-8-12/h4-11H,1-3H3
InChIKeyZSJYSIZYJPKJLU-UHFFFAOYSA-N
XLogP2.88
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-phenyl-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 109111797
N-methyl-N-phenylcinnoline-3-carboxamide
CID 110705116
6-(2-bromoanilino)-N-methyl-N-phenylpyridazine-3-carboxamide
CID 109127277
6-(4-formylpiperazin-1-yl)-N-methyl-N-phenylpyridazine-3-carboxamide
CID 109116837
N-methyl-N-phenyl-1,2-oxazole-3-carboxamide
CID 91235694
N-methyl-N-phenyl-5-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109197573
6-(3-fluoroanilino)-N-methyl-N-phenylpyridazine-3-carboxamide
CID 109127276
N-methyl-N-phenyl-2H-triazole-4-carboxamide
CID 78968210
methyl [6-[methyl(phenyl)carbamoyl]-3-pyridinyl] carbonate
CID 23177300
6-(4-bromo-2-methylanilino)-N-methyl-N-phenylpyridazine-3-carboxamide
CID 109127280
N,2-dimethyl-N-phenyl-1,3-thiazole-4-carboxamide
CID 110649635
6-methoxy-N-methyl-N-phenylpyridine-2-carboxamide
CID 110856921

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide?
The IUPAC name of N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide (CID 113200408) is N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide?
The canonical SMILES for N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide is CC(C)c1ccc(C(=O)N(C)c2ccccc2)nn1.
What is the InChIKey of N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide?
The InChIKey is ZSJYSIZYJPKJLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-11(2)13-9-10-14(17-16-13)15(19)18(3)12-7-5-4-6-8-12/h4-11H,1-3H3.
What are the key properties of N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide?
N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.88, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenyl-6-propan-2-ylpyridazine-3-carboxamide is sourced from PubChem (CID 113200408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).