6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide

C13H11Cl2N3O — CID 61042386

IUPAC6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide
SMILESCC(NC(=O)c1ccc(Cl)nn1)c1ccccc1Cl
InChIInChI=1S/C13H11Cl2N3O/c1-8(9-4-2-3-5-10(9)14)16-13(19)11-6-7-12(15)18-17-11/h2-8H,1H3,(H,16,19)
InChIKeyOAZGCRZWMFZNNM-UHFFFAOYSA-N
MW296.16 g/mol
LogP3.27
Rot. Bonds3

About 6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide

6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide (PubChem CID 61042386) has the molecular formula C13H11Cl2N3O and a molecular weight of 296.16 g/mol. Its IUPAC name is 6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide
PubChem CID61042386
Molecular FormulaC13H11Cl2N3O
Molecular Weight296.16 g/mol
Exact Mass295.03
IUPAC Name6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide
SMILESCC(NC(=O)c1ccc(Cl)nn1)c1ccccc1Cl
InChIInChI=1S/C13H11Cl2N3O/c1-8(9-4-2-3-5-10(9)14)16-13(19)11-6-7-12(15)18-17-11/h2-8H,1H3,(H,16,19)
InChIKeyOAZGCRZWMFZNNM-UHFFFAOYSA-N
XLogP3.27
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.16
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-N-[1-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide
CID 61041832
3,6-dichloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-4-carboxamide
CID 103606462
6-chloro-N-[1-(2-chlorophenyl)propan-2-yl]pyridazine-3-carboxamide
CID 61040940
N-[1-(2-chlorophenyl)ethyl]-5-methylpyrazine-2-carboxamide
CID 42905859
N-[1-(2-chlorophenyl)ethyl]-1H-pyrazole-4-carboxamide
CID 60786137
N-[1-(2-chlorophenyl)ethyl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 171677155
6-chloro-N-[1-(3,4-difluorophenyl)ethyl]pyridazine-3-carboxamide
CID 61040801
4-chloro-N-[1-(2-chlorophenyl)ethyl]-1H-pyrrole-2-carboxamide
CID 134012860
1-[(1S)-1-(2-chlorophenyl)ethyl]-3-propan-2-ylurea
CID 29026170
2-(aminomethyl)-N-[1-(2-chlorophenyl)ethyl]-1,3-thiazole-4-carboxamide
CID 66375562
N-[(1R)-1-(2-chlorophenyl)ethyl]-2-(methylamino)benzamide
CID 81379610
2-chloro-N-[1-(2-chlorophenyl)ethyl]-5-hydroxybenzamide
CID 106501562

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide (CID 61042386) is 6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide is CC(NC(=O)c1ccc(Cl)nn1)c1ccccc1Cl.
What is the InChIKey of 6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide?
The InChIKey is OAZGCRZWMFZNNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2N3O/c1-8(9-4-2-3-5-10(9)14)16-13(19)11-6-7-12(15)18-17-11/h2-8H,1H3,(H,16,19).
What are the key properties of 6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide?
6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide has a molecular weight of 296.16 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[1-(2-chlorophenyl)ethyl]pyridazine-3-carboxamide is sourced from PubChem (CID 61042386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).