6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide

C14H13ClN4O2 — CID 61041368

IUPAC6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide
SMILESCN(C)C(=O)c1cccc(NC(=O)c2ccc(Cl)nn2)c1
InChIInChI=1S/C14H13ClN4O2/c1-19(2)14(21)9-4-3-5-10(8-9)16-13(20)11-6-7-12(15)18-17-11/h3-8H,1-2H3,(H,16,20)
InChIKeyIVFBPFRQHLPCGM-UHFFFAOYSA-N
MW304.74 g/mol
LogP2.08
Rot. Bonds3

About 6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide

6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide (PubChem CID 61041368) has the molecular formula C14H13ClN4O2 and a molecular weight of 304.74 g/mol. Its IUPAC name is 6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide
PubChem CID61041368
Molecular FormulaC14H13ClN4O2
Molecular Weight304.74 g/mol
Exact Mass304.07
IUPAC Name6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide
SMILESCN(C)C(=O)c1cccc(NC(=O)c2ccc(Cl)nn2)c1
InChIInChI=1S/C14H13ClN4O2/c1-19(2)14(21)9-4-3-5-10(8-9)16-13(20)11-6-7-12(15)18-17-11/h3-8H,1-2H3,(H,16,20)
InChIKeyIVFBPFRQHLPCGM-UHFFFAOYSA-N
XLogP2.08
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.74
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-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

N-[3-(dimethylcarbamoyl)phenyl]-1H-pyrazole-4-carboxamide
CID 60786152
6-chloro-N-(3,4-dichlorophenyl)pyridazine-3-carboxamide
CID 54926951
3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide
CID 134037398
N,N-dimethyl-3-[(4-phenylbenzoyl)amino]benzamide
CID 17231735
N,N'-bis[3-(dimethylcarbamoyl)phenyl]butanediamide
CID 17232267
N-(4-acetamidophenyl)-6-chloropyridazine-3-carboxamide
CID 60859038
4-amino-N-[3-(dimethylcarbamoyl)phenyl]-1H-pyrrole-2-carboxamide
CID 61110887
3-[[2-(4-chlorophenyl)acetyl]amino]-N,N-dimethylbenzamide
CID 17231829
N-[3-(dimethylcarbamoyl)phenyl]-3,5-dinitrobenzamide
CID 17231768
3-[(3-chlorobenzoyl)carbamothioylamino]-N,N-dimethylbenzamide
CID 17232103
3-[(4-chlorobenzoyl)carbamothioylamino]-N,N-dimethylbenzamide
CID 17232054
N,N-dimethyl-3-(methylamino)benzamide;ethane
CID 91408702

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide (CID 61041368) is 6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide is CN(C)C(=O)c1cccc(NC(=O)c2ccc(Cl)nn2)c1.
What is the InChIKey of 6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide?
The InChIKey is IVFBPFRQHLPCGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN4O2/c1-19(2)14(21)9-4-3-5-10(8-9)16-13(20)11-6-7-12(15)18-17-11/h3-8H,1-2H3,(H,16,20).
What are the key properties of 6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide?
6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide has a molecular weight of 304.74 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[3-(dimethylcarbamoyl)phenyl]pyridazine-3-carboxamide is sourced from PubChem (CID 61041368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).