N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide

C18H23ClN4O2 — CID 109126166

IUPACN-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide
SMILESCCCN(CCC)c1ccc(C(=O)Nc2cc(Cl)ccc2OC)nn1
InChIInChI=1S/C18H23ClN4O2/c1-4-10-23(11-5-2)17-9-7-14(21-22-17)18(24)20-15-12-13(19)6-8-16(15)25-3/h6-9,12H,4-5,10-11H2,1-3H3,(H,20,24)
InChIKeyJXLVNVQGQYWCDL-UHFFFAOYSA-N
MW362.86 g/mol
LogP4.02
Rot. Bonds8

About N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide

N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide (PubChem CID 109126166) has the molecular formula C18H23ClN4O2 and a molecular weight of 362.86 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide
PubChem CID109126166
Molecular FormulaC18H23ClN4O2
Molecular Weight362.86 g/mol
Exact Mass362.15
IUPAC NameN-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide
SMILESCCCN(CCC)c1ccc(C(=O)Nc2cc(Cl)ccc2OC)nn1
InChIInChI=1S/C18H23ClN4O2/c1-4-10-23(11-5-2)17-9-7-14(21-22-17)18(24)20-15-12-13(19)6-8-16(15)25-3/h6-9,12H,4-5,10-11H2,1-3H3,(H,20,24)
InChIKeyJXLVNVQGQYWCDL-UHFFFAOYSA-N
XLogP4.02
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.86
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridazine-3-carboxamide
CID 109126173
N-(5-chloro-2-methoxyphenyl)-2-(dipropylamino)pyridine-4-carboxamide
CID 109175912
N-(5-chloro-2-methoxyphenyl)-2-(dipropylamino)pyrimidine-4-carboxamide
CID 109312912
N-(5-chloro-2-methoxyphenyl)-6-(prop-2-enylamino)pyridazine-3-carboxamide
CID 109110309
6-N-butyl-2-N-(5-chloro-2-methoxyphenyl)-6-N-methylpyridine-2,6-dicarboxamide
CID 109099568
6-(diethylamino)-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109124336
N-(5-chloro-2-methoxyphenyl)-6-(cyclopropylamino)pyridazine-3-carboxamide
CID 109109916
ethyl 2-[[6-(dipropylamino)pyridazine-3-carbonyl]amino]benzoate
CID 109126207
N-(5-chloro-2-methoxyphenyl)-6-[(2-methoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 109120023
N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide
CID 2111763
6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109161821
N-(5-chloro-2-methoxyphenyl)-5-(pentylamino)pyridine-2-carboxamide
CID 109195860

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide (CID 109126166) is N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide is CCCN(CCC)c1ccc(C(=O)Nc2cc(Cl)ccc2OC)nn1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide?
The InChIKey is JXLVNVQGQYWCDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23ClN4O2/c1-4-10-23(11-5-2)17-9-7-14(21-22-17)18(24)20-15-12-13(19)6-8-16(15)25-3/h6-9,12H,4-5,10-11H2,1-3H3,(H,20,24).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide?
N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide has a molecular weight of 362.86 g/mol, XLogP of 4.02, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-6-(dipropylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 109126166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).