N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine

C19H19ClN4 — CID 67452963

IUPACN-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine
SMILESCC(C)(CNc1ccc(-c2cccnc2)nn1)c1ccccc1Cl
InChIInChI=1S/C19H19ClN4/c1-19(2,15-7-3-4-8-16(15)20)13-22-18-10-9-17(23-24-18)14-6-5-11-21-12-14/h3-12H,13H2,1-2H3,(H,22,24)
InChIKeyFSALETQOUMFYTG-UHFFFAOYSA-N
MW338.84 g/mol
LogP4.58
Rot. Bonds5

About N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine

N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine (PubChem CID 67452963) has the molecular formula C19H19ClN4 and a molecular weight of 338.84 g/mol. Its IUPAC name is N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine.

Molecular Properties

Compound NameN-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine
PubChem CID67452963
Molecular FormulaC19H19ClN4
Molecular Weight338.84 g/mol
Exact Mass338.13
IUPAC NameN-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine
SMILESCC(C)(CNc1ccc(-c2cccnc2)nn1)c1ccccc1Cl
InChIInChI=1S/C19H19ClN4/c1-19(2,15-7-3-4-8-16(15)20)13-22-18-10-9-17(23-24-18)14-6-5-11-21-12-14/h3-12H,13H2,1-2H3,(H,22,24)
InChIKeyFSALETQOUMFYTG-UHFFFAOYSA-N
XLogP4.58
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.84
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine 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

2-N-(6-pyridin-3-ylpyridazin-3-yl)propane-1,2-diamine
CID 116970540
3-phenyl-6-pyridin-3-ylpyridazine
CID 12712239
2-[(6-pyridin-3-ylpyridazin-3-yl)amino]propanoic acid
CID 116971458
2,2-dimethyl-N'-(6-phenylpyridazin-3-yl)propane-1,3-diamine
CID 116970880
3-methyl-6-pyridin-3-ylpyridazine
CID 89161646
N-(3-methyl-1-pyridin-3-ylbutyl)-6-phenylpyridazin-3-amine
CID 134697190
N-[(2R)-2-(2-chlorophenyl)-2-hydroxypropyl]-2-pyridin-3-ylacetamide
CID 99701809
N-(2-tert-butylphenyl)-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide
CID 109121006
2-methyl-N-[6-(pyridin-3-ylmethylamino)pyridazin-3-yl]propanamide
CID 113042074
N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide
CID 86806095
6-(2-chlorophenyl)-N-[2-(3-fluoro-4-pyridinyl)ethyl]pyridazin-3-amine
CID 167812518
tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane
CID 140557189

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine?
The IUPAC name of N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine (CID 67452963) is N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine.
What is the SMILES notation for N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine?
The canonical SMILES for N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine is CC(C)(CNc1ccc(-c2cccnc2)nn1)c1ccccc1Cl.
What is the InChIKey of N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine?
The InChIKey is FSALETQOUMFYTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN4/c1-19(2,15-7-3-4-8-16(15)20)13-22-18-10-9-17(23-24-18)14-6-5-11-21-12-14/h3-12H,13H2,1-2H3,(H,22,24).
What are the key properties of N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine?
N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine has a molecular weight of 338.84 g/mol, XLogP of 4.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chlorophenyl)-2-methylpropyl]-6-pyridin-3-ylpyridazin-3-amine is sourced from PubChem (CID 67452963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).