6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide

C13H12ClN3O2 — CID 61237341

IUPAC6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide
SMILESO=C(Nc1ccc(CCO)cc1)c1ccc(Cl)nn1
InChIInChI=1S/C13H12ClN3O2/c14-12-6-5-11(16-17-12)13(19)15-10-3-1-9(2-4-10)7-8-18/h1-6,18H,7-8H2,(H,15,19)
InChIKeyJOHDFBHHPOGHGE-UHFFFAOYSA-N
MW277.71 g/mol
LogP1.92
Rot. Bonds4

About 6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide

6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide (PubChem CID 61237341) has the molecular formula C13H12ClN3O2 and a molecular weight of 277.71 g/mol. Its IUPAC name is 6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide
PubChem CID61237341
Molecular FormulaC13H12ClN3O2
Molecular Weight277.71 g/mol
Exact Mass277.06
IUPAC Name6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide
SMILESO=C(Nc1ccc(CCO)cc1)c1ccc(Cl)nn1
InChIInChI=1S/C13H12ClN3O2/c14-12-6-5-11(16-17-12)13(19)15-10-3-1-9(2-4-10)7-8-18/h1-6,18H,7-8H2,(H,15,19)
InChIKeyJOHDFBHHPOGHGE-UHFFFAOYSA-N
XLogP1.92
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.71
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide
CID 55041891
N-(4-acetamidophenyl)-6-chloropyridazine-3-carboxamide
CID 60859038
3,6-dichloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-4-carboxamide
CID 61221964
5-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-carboxamide
CID 104642279
6-chloro-N-(3,4-dichlorophenyl)pyridazine-3-carboxamide
CID 54926951
N-[4-(2-hydroxyethyl)phenyl]pyridine-2-carboxamide
CID 61223962
6-[[4-(2-hydroxyethyl)phenyl]carbamoyl]pyridine-3-carboxylic acid
CID 61236807
methyl 4-[(6-chloropyridazine-3-carbonyl)amino]benzoate
CID 61041834
6-chloropyridazine-3-carbohydrazide
CID 10080848
6-chloro-N-(4-chloro-3-fluorophenyl)pyridazine-3-carboxamide
CID 61042452
6-chloro-N-[(4-fluorophenyl)methyl]pyridazine-3-carboxamide
CID 60858368
N-[4-(2-hydroxyethyl)phenyl]acetamide
CID 3295905

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide (CID 61237341) is 6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide is O=C(Nc1ccc(CCO)cc1)c1ccc(Cl)nn1.
What is the InChIKey of 6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide?
The InChIKey is JOHDFBHHPOGHGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClN3O2/c14-12-6-5-11(16-17-12)13(19)15-10-3-1-9(2-4-10)7-8-18/h1-6,18H,7-8H2,(H,15,19).
What are the key properties of 6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide?
6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide has a molecular weight of 277.71 g/mol, XLogP of 1.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-3-carboxamide is sourced from PubChem (CID 61237341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).