6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide

C16H18N4O — CID 109109890

IUPAC6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide
SMILESCc1cc(C)cc(NC(=O)c2ccc(NC3CC3)nn2)c1
InChIInChI=1S/C16H18N4O/c1-10-7-11(2)9-13(8-10)18-16(21)14-5-6-15(20-19-14)17-12-3-4-12/h5-9,12H,3-4H2,1-2H3,(H,17,20)(H,18,21)
InChIKeySJWDVYNPPORZDS-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.92
Rot. Bonds4

About 6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide

6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide (PubChem CID 109109890) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is 6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide
PubChem CID109109890
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide
SMILESCc1cc(C)cc(NC(=O)c2ccc(NC3CC3)nn2)c1
InChIInChI=1S/C16H18N4O/c1-10-7-11(2)9-13(8-10)18-16(21)14-5-6-15(20-19-14)17-12-3-4-12/h5-9,12H,3-4H2,1-2H3,(H,17,20)(H,18,21)
InChIKeySJWDVYNPPORZDS-UHFFFAOYSA-N
XLogP2.92
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetamidophenyl)-6-(cyclopropylamino)pyridazine-3-carboxamide
CID 109109935
N-(3-bromo-4-methylphenyl)-6-(cyclopentylamino)pyridazine-3-carboxamide
CID 109112196
N-(3,5-dimethylphenyl)-6-(propan-2-ylamino)pyridazine-3-carboxamide
CID 109109497
6-(cyclopropylamino)-N-[4-(diethylamino)phenyl]pyridazine-3-carboxamide
CID 109109943
N-(3,5-dimethylphenyl)-6-(oxolan-2-ylmethylamino)pyridazine-3-carboxamide
CID 109114879
N-(4-chlorophenyl)-6-(cyclopentylamino)pyridazine-3-carboxamide
CID 109112186
6-(cycloheptylamino)-N-phenylpyridazine-3-carboxamide
CID 109124960
5-(cyclopentylamino)-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109182436
5-(cyclopentylamino)-N-(3,5-dimethylphenyl)pyrazine-2-carboxamide
CID 109274163
6-(cyclopropylamino)-N-[4-(4-methylpiperidin-1-yl)phenyl]pyridazine-3-carboxamide
CID 109109946
N-(3-fluoro-5-methylphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 79047301
6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide
CID 109112976

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide (CID 109109890) is 6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide is Cc1cc(C)cc(NC(=O)c2ccc(NC3CC3)nn2)c1.
What is the InChIKey of 6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide?
The InChIKey is SJWDVYNPPORZDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-10-7-11(2)9-13(8-10)18-16(21)14-5-6-15(20-19-14)17-12-3-4-12/h5-9,12H,3-4H2,1-2H3,(H,17,20)(H,18,21).
What are the key properties of 6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide?
6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide has a molecular weight of 282.35 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109109890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).