6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide

C22H25N5O — CID 133313365

IUPAC6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide
SMILESCN(C)C(CNc1ccc(C(=O)Nc2ccccc2)nn1)Cc1ccccc1
InChIInChI=1S/C22H25N5O/c1-27(2)19(15-17-9-5-3-6-10-17)16-23-21-14-13-20(25-26-21)22(28)24-18-11-7-4-8-12-18/h3-14,19H,15-16H2,1-2H3,(H,23,26)(H,24,28)
InChIKeyBRYJDFTUSAUWMP-UHFFFAOYSA-N
MW375.48 g/mol
LogP3.31
Rot. Bonds8

About 6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide

6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide (PubChem CID 133313365) has the molecular formula C22H25N5O and a molecular weight of 375.48 g/mol. Its IUPAC name is 6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide
PubChem CID133313365
Molecular FormulaC22H25N5O
Molecular Weight375.48 g/mol
Exact Mass375.21
IUPAC Name6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide
SMILESCN(C)C(CNc1ccc(C(=O)Nc2ccccc2)nn1)Cc1ccccc1
InChIInChI=1S/C22H25N5O/c1-27(2)19(15-17-9-5-3-6-10-17)16-23-21-14-13-20(25-26-21)22(28)24-18-11-7-4-8-12-18/h3-14,19H,15-16H2,1-2H3,(H,23,26)(H,24,28)
InChIKeyBRYJDFTUSAUWMP-UHFFFAOYSA-N
XLogP3.31
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.48
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-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-(dimethylamino)-2-phenylethyl]amino]-N-phenylpyridazine-3-carboxamide
CID 133313257
6-(3-methylbutylamino)-N-phenylpyridazine-3-carboxamide
CID 109125155
N-(4-ethylphenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide
CID 109111062
6-[[4-(methylsulfonylmethyl)phenyl]methylamino]-N-phenylpyridazine-3-carboxamide
CID 133313960
6-(2-methylpropylamino)-N-(4-propan-2-ylphenyl)pyridazine-3-carboxamide
CID 109111066
6-(4-ethylanilino)-N-phenylpyridazine-3-carboxamide
CID 109126657
N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide
CID 109111085
6-[(3,4-dimethoxyphenyl)methylamino]-N-phenylpyridazine-3-carboxamide
CID 109123429
6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide
CID 133313334
N-(3-acetylphenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide
CID 109111101
6-(benzylamino)-N-[4-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
CID 109117791
6-(benzylamino)-N-(4-pyrrolidin-1-ylphenyl)pyridazine-3-carboxamide
CID 109117802

Frequently Asked Questions

What is the IUPAC name of 6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide?
The IUPAC name of 6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide (CID 133313365) is 6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide.
What is the SMILES notation for 6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide?
The canonical SMILES for 6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide is CN(C)C(CNc1ccc(C(=O)Nc2ccccc2)nn1)Cc1ccccc1.
What is the InChIKey of 6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide?
The InChIKey is BRYJDFTUSAUWMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O/c1-27(2)19(15-17-9-5-3-6-10-17)16-23-21-14-13-20(25-26-21)22(28)24-18-11-7-4-8-12-18/h3-14,19H,15-16H2,1-2H3,(H,23,26)(H,24,28).
What are the key properties of 6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide?
6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide has a molecular weight of 375.48 g/mol, XLogP of 3.31, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[2-(dimethylamino)-3-phenylpropyl]amino]-N-phenylpyridazine-3-carboxamide is sourced from PubChem (CID 133313365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).