N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide

C15H17N3O2 — CID 90509536

IUPACN-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide
SMILESCCOc1ccc(C(=O)Nc2cc(C)cc(C)c2)nn1
InChIInChI=1S/C15H17N3O2/c1-4-20-14-6-5-13(17-18-14)15(19)16-12-8-10(2)7-11(3)9-12/h5-9H,4H2,1-3H3,(H,16,19)
InChIKeyGANYHOCWHAVYFV-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.74
Rot. Bonds4

About N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide

N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide (PubChem CID 90509536) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide
PubChem CID90509536
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide
SMILESCCOc1ccc(C(=O)Nc2cc(C)cc(C)c2)nn1
InChIInChI=1S/C15H17N3O2/c1-4-20-14-6-5-13(17-18-14)15(19)16-12-8-10(2)7-11(3)9-12/h5-9H,4H2,1-3H3,(H,16,19)
InChIKeyGANYHOCWHAVYFV-UHFFFAOYSA-N
XLogP2.74
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-difluorophenyl)-6-ethoxypyridazine-3-carboxamide
CID 90509652
N-[4-(diethylamino)-2-methylphenyl]-6-ethoxypyridazine-3-carboxamide
CID 90509599
ethyl 4-[[6-[(3,5-dimethylphenyl)carbamoyl]pyridazin-3-yl]amino]benzoate
CID 109127759
N-(2-amino-2-oxoethyl)-6-ethoxypyridazine-3-carboxamide
CID 90509671
6-ethoxy-N-(2-methylsulfanylphenyl)pyridazine-3-carboxamide
CID 90509597
6-ethoxy-N-(2-oxochromen-3-yl)pyridazine-3-carboxamide
CID 90509622
N-[2-[(4-acetamidobenzoyl)amino]ethyl]-6-ethoxypyridazine-3-carboxamide
CID 90509701
N-(3,5-dimethylphenyl)-6-(propan-2-ylamino)pyridazine-3-carboxamide
CID 109109497
N-(3,5-dimethylphenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109219935
N-(3,5-dimethylphenyl)-2-(4-ethoxyanilino)-1,3-thiazole-4-carboxamide
CID 16954928
6-ethoxy-N-(4-methylphenyl)pyrimidine-4-carboxamide
CID 121167580
6-ethoxy-N-(4-methyl-1,3-benzothiazol-2-yl)pyridazine-3-carboxamide
CID 90509660

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide?
The IUPAC name of N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide (CID 90509536) is N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide is CCOc1ccc(C(=O)Nc2cc(C)cc(C)c2)nn1.
What is the InChIKey of N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide?
The InChIKey is GANYHOCWHAVYFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-4-20-14-6-5-13(17-18-14)15(19)16-12-8-10(2)7-11(3)9-12/h5-9H,4H2,1-3H3,(H,16,19).
What are the key properties of N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide?
N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-6-ethoxypyridazine-3-carboxamide is sourced from PubChem (CID 90509536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).