N-(6-chloropyridazin-3-yl)benzamide

C11H8ClN3O — CID 13125576

IUPACN-(6-chloropyridazin-3-yl)benzamide
SMILESO=C(Nc1ccc(Cl)nn1)c1ccccc1
InChIInChI=1S/C11H8ClN3O/c12-9-6-7-10(15-14-9)13-11(16)8-4-2-1-3-5-8/h1-7H,(H,13,15,16)
InChIKeyIQQXLFXHVPPXQO-UHFFFAOYSA-N
MW233.66 g/mol
LogP2.38
Rot. Bonds2

About N-(6-chloropyridazin-3-yl)benzamide

N-(6-chloropyridazin-3-yl)benzamide (PubChem CID 13125576) has the molecular formula C11H8ClN3O and a molecular weight of 233.66 g/mol. Its IUPAC name is N-(6-chloropyridazin-3-yl)benzamide.

Molecular Properties

Compound NameN-(6-chloropyridazin-3-yl)benzamide
PubChem CID13125576
Molecular FormulaC11H8ClN3O
Molecular Weight233.66 g/mol
Exact Mass233.04
IUPAC NameN-(6-chloropyridazin-3-yl)benzamide
SMILESO=C(Nc1ccc(Cl)nn1)c1ccccc1
InChIInChI=1S/C11H8ClN3O/c12-9-6-7-10(15-14-9)13-11(16)8-4-2-1-3-5-8/h1-7H,(H,13,15,16)
InChIKeyIQQXLFXHVPPXQO-UHFFFAOYSA-N
XLogP2.38
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.66
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-N-(6-chloropyridazin-3-yl)benzamide
CID 113230922
3-chloro-N-(6-chloropyridazin-3-yl)-4-fluorobenzamide
CID 115737291
N-(6-chloropyridazin-3-yl)-4-(methylsulfonylmethyl)benzamide
CID 56805495
4-butoxy-N-(6-chloropyridazin-3-yl)benzamide
CID 115608608
N-(6-chloropyridazin-3-yl)-2-(trifluoromethyl)pyrimidine-5-carboxamide
CID 91649769
N-(6-chloropyridazin-3-yl)-3-fluoro-5-methylbenzamide
CID 115666665
4-chloro-N'-(6-chloropyridazin-3-yl)benzohydrazide
CID 6401637
N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide
CID 115608654
N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide
CID 113038827
N-[6-(2-methylpropylamino)pyridazin-3-yl]benzamide
CID 113038445
N-[6-(2-methylanilino)pyridazin-3-yl]benzamide
CID 113045593
5-chloro-N-(6-chloropyridazin-3-yl)furan-2-carboxamide
CID 115608607

Frequently Asked Questions

What is the IUPAC name of N-(6-chloropyridazin-3-yl)benzamide?
The IUPAC name of N-(6-chloropyridazin-3-yl)benzamide (CID 13125576) is N-(6-chloropyridazin-3-yl)benzamide.
What is the SMILES notation for N-(6-chloropyridazin-3-yl)benzamide?
The canonical SMILES for N-(6-chloropyridazin-3-yl)benzamide is O=C(Nc1ccc(Cl)nn1)c1ccccc1.
What is the InChIKey of N-(6-chloropyridazin-3-yl)benzamide?
The InChIKey is IQQXLFXHVPPXQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClN3O/c12-9-6-7-10(15-14-9)13-11(16)8-4-2-1-3-5-8/h1-7H,(H,13,15,16).
What are the key properties of N-(6-chloropyridazin-3-yl)benzamide?
N-(6-chloropyridazin-3-yl)benzamide has a molecular weight of 233.66 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloropyridazin-3-yl)benzamide is sourced from PubChem (CID 13125576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).