6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide

C13H18ClN3O — CID 54927092

IUPAC6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide
SMILESCCN(C(=O)c1ccc(Cl)nn1)C1CCCCC1
InChIInChI=1S/C13H18ClN3O/c1-2-17(10-6-4-3-5-7-10)13(18)11-8-9-12(14)16-15-11/h8-10H,2-7H2,1H3
InChIKeyKYEBQXSTORNWFK-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.92
Rot. Bonds3

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

6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide (PubChem CID 54927092) has the molecular formula C13H18ClN3O and a molecular weight of 267.76 g/mol. Its IUPAC name is 6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide
PubChem CID54927092
Molecular FormulaC13H18ClN3O
Molecular Weight267.76 g/mol
Exact Mass267.11
IUPAC Name6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide
SMILESCCN(C(=O)c1ccc(Cl)nn1)C1CCCCC1
InChIInChI=1S/C13H18ClN3O/c1-2-17(10-6-4-3-5-7-10)13(18)11-8-9-12(14)16-15-11/h8-10H,2-7H2,1H3
InChIKeyKYEBQXSTORNWFK-UHFFFAOYSA-N
XLogP2.92
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-N-ethyl-6-(methylamino)pyridazine-3-carboxamide
CID 55042606
6-chloro-N-cyclopentyl-N-ethylpyrazine-2-carboxamide
CID 103187282
6-chloro-N-(cyclopropylmethyl)-N-ethylpyridazine-3-carboxamide
CID 63955165
N-cyclopropyl-N-ethyl-6-(methylamino)pyridazine-3-carboxamide
CID 62168086
6-chloro-N-methyl-N-(3-methylcyclohexyl)pyridazine-3-carboxamide
CID 54949412
3-chloro-N-cyclohexyl-N-ethylpyridine-4-carboxamide
CID 66464797
5-[cyclohexyl(ethyl)carbamoyl]pyrazine-2-carboxylic acid
CID 120684743
2-chloro-N-cyclohexyl-N-ethylpyridine-3-carboxamide
CID 18069572
6-chloro-N-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]pyridazine-3-carboxamide
CID 61051446
5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide
CID 63723531
6-chloro-N-ethyl-N-(2-hydroxyethyl)pyridazine-3-carboxamide
CID 60980637
2-chloro-N-cyclohexyl-N-ethyl-6-hydrazinylpyridine-4-carboxamide
CID 62248666

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide (CID 54927092) is 6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide is CCN(C(=O)c1ccc(Cl)nn1)C1CCCCC1.
What is the InChIKey of 6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide?
The InChIKey is KYEBQXSTORNWFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN3O/c1-2-17(10-6-4-3-5-7-10)13(18)11-8-9-12(14)16-15-11/h8-10H,2-7H2,1H3.
What are the key properties of 6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide?
6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide has a molecular weight of 267.76 g/mol, XLogP of 2.92, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-cyclohexyl-N-ethylpyridazine-3-carboxamide is sourced from PubChem (CID 54927092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).