N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide

C17H15ClN4O3 — CID 113050980

IUPACN-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide
SMILESCOc1cc(Cl)c(C)cc1Nc1ccc(NC(=O)c2ccco2)nn1
InChIInChI=1S/C17H15ClN4O3/c1-10-8-12(14(24-2)9-11(10)18)19-15-5-6-16(22-21-15)20-17(23)13-4-3-7-25-13/h3-9H,1-2H3,(H,19,21)(H,20,22,23)
InChIKeyWFMDSDFJZZUROU-UHFFFAOYSA-N
MW358.79 g/mol
LogP4.04
Rot. Bonds5

About N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide

N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide (PubChem CID 113050980) has the molecular formula C17H15ClN4O3 and a molecular weight of 358.79 g/mol. Its IUPAC name is N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide
PubChem CID113050980
Molecular FormulaC17H15ClN4O3
Molecular Weight358.79 g/mol
Exact Mass358.08
IUPAC NameN-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide
SMILESCOc1cc(Cl)c(C)cc1Nc1ccc(NC(=O)c2ccco2)nn1
InChIInChI=1S/C17H15ClN4O3/c1-10-8-12(14(24-2)9-11(10)18)19-15-5-6-16(22-21-15)20-17(23)13-4-3-7-25-13/h3-9H,1-2H3,(H,19,21)(H,20,22,23)
InChIKeyWFMDSDFJZZUROU-UHFFFAOYSA-N
XLogP4.04
TPSA89.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.79
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[6-(3-chloro-4-methylanilino)pyridazin-3-yl]furan-2-carboxamide
CID 113047767
N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]cyclobutanecarboxamide
CID 113050998
6-(4-chloro-2-methoxy-5-methylanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide
CID 109128448
6-(4-chloro-2-methoxy-5-methylanilino)-N-(3-fluorophenyl)pyridazine-3-carboxamide
CID 109130116
2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide
CID 113048567
6-(4-chloro-2-methoxy-5-methylanilino)-N-(pyridin-4-ylmethyl)pyridazine-3-carboxamide
CID 109121501
N-[2-(2-chlorobenzoyl)-4,5-dimethoxyphenyl]furan-2-carboxamide
CID 2989497
N-[6-[4-chloro-3-(trifluoromethyl)anilino]pyridazin-3-yl]furan-2-carboxamide
CID 113050628
6-(4-chloro-2-methoxy-5-methylanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide
CID 109114435
3-(4-chloro-2-methoxy-5-methylanilino)-6-(dimethylsulfamoylamino)pyridazine
CID 113051006
N-[6-(2,4-difluoroanilino)pyridazin-3-yl]furan-2-carboxamide
CID 113050490
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(furan-2-yl)acetamide
CID 110690762

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide?
The IUPAC name of N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide (CID 113050980) is N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide.
What is the SMILES notation for N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide?
The canonical SMILES for N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide is COc1cc(Cl)c(C)cc1Nc1ccc(NC(=O)c2ccco2)nn1.
What is the InChIKey of N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide?
The InChIKey is WFMDSDFJZZUROU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN4O3/c1-10-8-12(14(24-2)9-11(10)18)19-15-5-6-16(22-21-15)20-17(23)13-4-3-7-25-13/h3-9H,1-2H3,(H,19,21)(H,20,22,23).
What are the key properties of N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide?
N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide has a molecular weight of 358.79 g/mol, XLogP of 4.04, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide is sourced from PubChem (CID 113050980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).