N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide

C14H12Cl2N4O — CID 109110170

IUPACN-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide
SMILESO=C(NC1CC1)c1ccc(Nc2c(Cl)cccc2Cl)nn1
InChIInChI=1S/C14H12Cl2N4O/c15-9-2-1-3-10(16)13(9)18-12-7-6-11(19-20-12)14(21)17-8-4-5-8/h1-3,6-8H,4-5H2,(H,17,21)(H,18,20)
InChIKeyAMXSPLMXNJLMQF-UHFFFAOYSA-N
MW323.18 g/mol
LogP3.42
Rot. Bonds4

About N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide

N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide (PubChem CID 109110170) has the molecular formula C14H12Cl2N4O and a molecular weight of 323.18 g/mol. Its IUPAC name is N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide
PubChem CID109110170
Molecular FormulaC14H12Cl2N4O
Molecular Weight323.18 g/mol
Exact Mass322.04
IUPAC NameN-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide
SMILESO=C(NC1CC1)c1ccc(Nc2c(Cl)cccc2Cl)nn1
InChIInChI=1S/C14H12Cl2N4O/c15-9-2-1-3-10(16)13(9)18-12-7-6-11(19-20-12)14(21)17-8-4-5-8/h1-3,6-8H,4-5H2,(H,17,21)(H,18,20)
InChIKeyAMXSPLMXNJLMQF-UHFFFAOYSA-N
XLogP3.42
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.18
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-5-(2,6-dichloroanilino)pyrazine-2-carboxamide
CID 109271734
N-cyclopropyl-6-(2,6-dichloroanilino)pyrimidine-4-carboxamide
CID 109339399
6-(2,6-dichloroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide
CID 109114069
6-(4-chloroanilino)-N-cyclopentylpyridazine-3-carboxamide
CID 109112372
N-benzyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide
CID 109117975
N-cyclopropyl-6-[3-(trifluoromethyl)anilino]pyridazine-3-carboxamide
CID 109110127
6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115771
6-(cycloheptylamino)-N-cyclopropylpyridazine-3-carboxamide
CID 109110063
6-(4-cyanoanilino)-N-cyclopropylpyridazine-3-carboxamide
CID 109110178
6-(3-chloro-4-fluoroanilino)-N-cyclohexylpyridazine-3-carboxamide
CID 109113080
N-(2-cyanophenyl)-6-(2,6-dichloroanilino)pyridazine-3-carboxamide
CID 109130305
N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide
CID 109112077

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide?
The IUPAC name of N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide (CID 109110170) is N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide is O=C(NC1CC1)c1ccc(Nc2c(Cl)cccc2Cl)nn1.
What is the InChIKey of N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide?
The InChIKey is AMXSPLMXNJLMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N4O/c15-9-2-1-3-10(16)13(9)18-12-7-6-11(19-20-12)14(21)17-8-4-5-8/h1-3,6-8H,4-5H2,(H,17,21)(H,18,20).
What are the key properties of N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide?
N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide has a molecular weight of 323.18 g/mol, XLogP of 3.42, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-6-(2,6-dichloroanilino)pyridazine-3-carboxamide is sourced from PubChem (CID 109110170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).