6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide

C15H17ClN4O — CID 109109231

IUPAC6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide
SMILESCCCNC(=O)c1ccc(NCc2ccccc2Cl)nn1
InChIInChI=1S/C15H17ClN4O/c1-2-9-17-15(21)13-7-8-14(20-19-13)18-10-11-5-3-4-6-12(11)16/h3-8H,2,9-10H2,1H3,(H,17,21)(H,18,20)
InChIKeyBHFDALBMWSKHBA-UHFFFAOYSA-N
MW304.78 g/mol
LogP2.88
Rot. Bonds6

About 6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide

6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide (PubChem CID 109109231) has the molecular formula C15H17ClN4O and a molecular weight of 304.78 g/mol. Its IUPAC name is 6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide
PubChem CID109109231
Molecular FormulaC15H17ClN4O
Molecular Weight304.78 g/mol
Exact Mass304.11
IUPAC Name6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide
SMILESCCCNC(=O)c1ccc(NCc2ccccc2Cl)nn1
InChIInChI=1S/C15H17ClN4O/c1-2-9-17-15(21)13-7-8-14(20-19-13)18-10-11-5-3-4-6-12(11)16/h3-8H,2,9-10H2,1H3,(H,17,21)(H,18,20)
InChIKeyBHFDALBMWSKHBA-UHFFFAOYSA-N
XLogP2.88
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(2-chlorophenyl)methylamino]-N-[3-(dimethylamino)propyl]pyridazine-3-carboxamide
CID 109115965
6-[(2-chlorophenyl)methylamino]-N-prop-2-enylpyridazine-3-carboxamide
CID 109110410
N-butan-2-yl-6-[(2-chlorophenyl)methylamino]pyridazine-3-carboxamide
CID 109111563
N-butyl-6-[(2-methylphenyl)methylamino]pyridazine-3-carboxamide
CID 109110791
N-propyl-6-(propylamino)pyridazine-3-carboxamide
CID 62172507
6-[(2-chlorophenyl)methylamino]-N-(2-methylphenyl)pyridazine-3-carboxamide
CID 109119670
N-[(2-chlorophenyl)methyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide
CID 109115796
6-[(2-chlorophenyl)methylamino]-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide
CID 109119678
6-[(2-chlorophenyl)methylamino]-N-(4-methoxyphenyl)pyridazine-3-carboxamide
CID 109119692
4-[(2-chlorophenyl)methylamino]-N-propylpyridine-2-carboxamide
CID 109201013
N-[2-(4-chlorophenyl)ethyl]-6-[(2-methylphenyl)methylamino]pyridazine-3-carboxamide
CID 109118017
N-[6-[(2-chlorophenyl)methylamino]pyridazin-3-yl]pentanamide
CID 113041528

Frequently Asked Questions

What is the IUPAC name of 6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide?
The IUPAC name of 6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide (CID 109109231) is 6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide.
What is the SMILES notation for 6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide?
The canonical SMILES for 6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide is CCCNC(=O)c1ccc(NCc2ccccc2Cl)nn1.
What is the InChIKey of 6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide?
The InChIKey is BHFDALBMWSKHBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN4O/c1-2-9-17-15(21)13-7-8-14(20-19-13)18-10-11-5-3-4-6-12(11)16/h3-8H,2,9-10H2,1H3,(H,17,21)(H,18,20).
What are the key properties of 6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide?
6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide has a molecular weight of 304.78 g/mol, XLogP of 2.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-chlorophenyl)methylamino]-N-propylpyridazine-3-carboxamide is sourced from PubChem (CID 109109231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).