6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide

C14H14ClN3O2 — CID 61041819

IUPAC6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(Cl)nn2)c(C)c1
InChIInChI=1S/C14H14ClN3O2/c1-3-20-10-4-5-11(9(2)8-10)16-14(19)12-6-7-13(15)18-17-12/h4-8H,3H2,1-2H3,(H,16,19)
InChIKeyWOZXBRGXXWFVJL-UHFFFAOYSA-N
MW291.74 g/mol
LogP3.09
Rot. Bonds4

About 6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide

6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide (PubChem CID 61041819) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is 6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide
PubChem CID61041819
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC Name6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(Cl)nn2)c(C)c1
InChIInChI=1S/C14H14ClN3O2/c1-3-20-10-4-5-11(9(2)8-10)16-14(19)12-6-7-13(15)18-17-12/h4-8H,3H2,1-2H3,(H,16,19)
InChIKeyWOZXBRGXXWFVJL-UHFFFAOYSA-N
XLogP3.09
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-(4-ethoxy-2-methylphenyl)furan-3-carboxamide
CID 106685543
3-chloro-N-(4-ethoxy-2-methylphenyl)pyridine-4-carboxamide
CID 66465000
3-amino-4-chloro-N-(4-ethoxy-2-methylphenyl)benzamide
CID 60928289
4-bromo-N-(4-ethoxy-2-methylphenyl)benzamide
CID 47267913
2-(aminomethyl)-N-(4-ethoxy-2-methylphenyl)-1,3-thiazole-4-carboxamide;hydrochloride
CID 119739998
3-chloro-N-(4-ethoxy-2-methylphenyl)propanamide
CID 60933888
2-chloro-N-(4-ethoxy-2-methylphenyl)propanamide
CID 60933889
5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide
CID 47312097
N-[4-(diethylamino)-2-methylphenyl]-6-ethoxypyridazine-3-carboxamide
CID 90509599
6-chloro-N-(3-ethoxy-1H-1,2,4-triazol-5-yl)pyridazine-3-carboxamide
CID 114037244
4-amino-N-(4-ethoxy-2-methylphenyl)-5-methyl-1H-pyrazole-3-carboxamide
CID 62083175
4-amino-N-(4-ethoxy-2-methylphenyl)-1H-pyrazole-5-carboxamide
CID 63103395

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide (CID 61041819) is 6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide is CCOc1ccc(NC(=O)c2ccc(Cl)nn2)c(C)c1.
What is the InChIKey of 6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide?
The InChIKey is WOZXBRGXXWFVJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c1-3-20-10-4-5-11(9(2)8-10)16-14(19)12-6-7-13(15)18-17-12/h4-8H,3H2,1-2H3,(H,16,19).
What are the key properties of 6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide?
6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide has a molecular weight of 291.74 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(4-ethoxy-2-methylphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 61041819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).