N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide

C14H14ClN3O — CID 60859356

IUPACN-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1ccc(Cl)nn1
InChIInChI=1S/C14H14ClN3O/c1-2-18(10-11-6-4-3-5-7-11)14(19)12-8-9-13(15)17-16-12/h3-9H,2,10H2,1H3
InChIKeyVFLOJZJOLHOBMX-UHFFFAOYSA-N
MW275.74 g/mol
LogP2.79
Rot. Bonds4

About N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide

N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide (PubChem CID 60859356) has the molecular formula C14H14ClN3O and a molecular weight of 275.74 g/mol. Its IUPAC name is N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide
PubChem CID60859356
Molecular FormulaC14H14ClN3O
Molecular Weight275.74 g/mol
Exact Mass275.08
IUPAC NameN-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1ccc(Cl)nn1
InChIInChI=1S/C14H14ClN3O/c1-2-18(10-11-6-4-3-5-7-11)14(19)12-8-9-13(15)17-16-12/h3-9H,2,10H2,1H3
InChIKeyVFLOJZJOLHOBMX-UHFFFAOYSA-N
XLogP2.79
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-benzyl-6-chloro-N-ethylpyridazine-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-benzyl-N-ethyl-6-hydrazinylpyridazine-3-carboxamide
CID 62243834
6-anilino-N-benzyl-N-ethylpyridazine-3-carboxamide
CID 109120604
6-chloro-N-ethyl-N-(2-hydroxyethyl)pyridazine-3-carboxamide
CID 60980637
N-benzyl-N-ethyl-6-(2-methylpropylamino)pyridazine-3-carboxamide
CID 109110994
N-benzyl-6-chloro-N-ethylimidazo[1,2-b]pyridazine-2-carboxamide
CID 87051180
6-chloro-N-(cyclopropylmethyl)-N-ethylpyridazine-3-carboxamide
CID 63955165
N-benzyl-N-ethyl-6-[(4-methylphenyl)methylamino]pyridazine-3-carboxamide
CID 109118471
N-benzyl-6-(5-chloro-2-methoxyanilino)-N-ethylpyridazine-3-carboxamide
CID 109120619
N-benzyl-N-ethyl-2-methyltriazole-4-carboxamide
CID 110691383
N-benzyl-N-ethyl-6-[(4-methoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 109120158
N-benzyl-N-ethylcarbamoyl chloride
CID 10679448
N,N'-dibenzyl-N,N'-diethyloxamide
CID 3417048

Frequently Asked Questions

What is the IUPAC name of N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide?
The IUPAC name of N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide (CID 60859356) is N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide.
What is the SMILES notation for N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide?
The canonical SMILES for N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide is CCN(Cc1ccccc1)C(=O)c1ccc(Cl)nn1.
What is the InChIKey of N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide?
The InChIKey is VFLOJZJOLHOBMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O/c1-2-18(10-11-6-4-3-5-7-11)14(19)12-8-9-13(15)17-16-12/h3-9H,2,10H2,1H3.
What are the key properties of N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide?
N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide has a molecular weight of 275.74 g/mol, XLogP of 2.79, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-6-chloro-N-ethylpyridazine-3-carboxamide is sourced from PubChem (CID 60859356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).