6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide

C18H24N4O3 — CID 109125613

IUPAC6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide
SMILESCCCCN(C)c1ccc(C(=O)Nc2ccc(OC)c(OC)c2)nn1
InChIInChI=1S/C18H24N4O3/c1-5-6-11-22(2)17-10-8-14(20-21-17)18(23)19-13-7-9-15(24-3)16(12-13)25-4/h7-10,12H,5-6,11H2,1-4H3,(H,19,23)
InChIKeyAFJJQVPDHFBRCP-UHFFFAOYSA-N
MW344.42 g/mol
LogP2.98
Rot. Bonds8

About 6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide

6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide (PubChem CID 109125613) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is 6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide
PubChem CID109125613
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC Name6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide
SMILESCCCCN(C)c1ccc(C(=O)Nc2ccc(OC)c(OC)c2)nn1
InChIInChI=1S/C18H24N4O3/c1-5-6-11-22(2)17-10-8-14(20-21-17)18(23)19-13-7-9-15(24-3)16(12-13)25-4/h7-10,12H,5-6,11H2,1-4H3,(H,19,23)
InChIKeyAFJJQVPDHFBRCP-UHFFFAOYSA-N
XLogP2.98
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-(diethylamino)-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109124336
6-[benzyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109119015
6-[butyl(methyl)amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridazine-3-carboxamide
CID 109125639
6-[butyl(methyl)amino]-N-(4-propan-2-ylphenyl)pyridazine-3-carboxamide
CID 109125585
6-[butyl(methyl)amino]-N-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
CID 109125615
6-[benzyl(methyl)amino]-N-(3-chloro-4-methoxyphenyl)pyridazine-3-carboxamide
CID 109119002
N-(3-chloro-4-methoxyphenyl)-6-(N-methylanilino)pyridazine-3-carboxamide
CID 109127167
6-[butyl(methyl)amino]-N-(3-chloro-2-methylphenyl)pyridazine-3-carboxamide
CID 109125594
N-(3,4-dimethoxyphenyl)-6-[4-(dimethylamino)anilino]pyridazine-3-carboxamide
CID 109129724
N-(2-methoxy-5-methylphenyl)-6-[methyl(2-pyridin-4-ylethyl)amino]pyridazine-3-carboxamide
CID 109122631
N-benzyl-6-[butyl(methyl)amino]pyridazine-3-carboxamide
CID 109117888
6-(tert-butylamino)-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109124776

Frequently Asked Questions

What is the IUPAC name of 6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide (CID 109125613) is 6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide is CCCCN(C)c1ccc(C(=O)Nc2ccc(OC)c(OC)c2)nn1.
What is the InChIKey of 6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide?
The InChIKey is AFJJQVPDHFBRCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-5-6-11-22(2)17-10-8-14(20-21-17)18(23)19-13-7-9-15(24-3)16(12-13)25-4/h7-10,12H,5-6,11H2,1-4H3,(H,19,23).
What are the key properties of 6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide?
6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 2.98, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109125613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).