6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine

C13H15N3O2 — CID 62203035

IUPAC6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine
SMILESCNc1ccc(-c2ccc(OC)c(OC)c2)nn1
InChIInChI=1S/C13H15N3O2/c1-14-13-7-5-10(15-16-13)9-4-6-11(17-2)12(8-9)18-3/h4-8H,1-3H3,(H,14,16)
InChIKeyBKPCCABNKCREDJ-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.20
Rot. Bonds4

About 6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine

6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine (PubChem CID 62203035) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine.

Molecular Properties

Compound Name6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine
PubChem CID62203035
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine
SMILESCNc1ccc(-c2ccc(OC)c(OC)c2)nn1
InChIInChI=1S/C13H15N3O2/c1-14-13-7-5-10(15-16-13)9-4-6-11(17-2)12(8-9)18-3/h4-8H,1-3H3,(H,14,16)
InChIKeyBKPCCABNKCREDJ-UHFFFAOYSA-N
XLogP2.20
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(3,4-dimethoxyphenyl)-N-methyl-1H-pyrazol-3-amine
CID 63047414
5-(3,4-dimethoxyphenyl)-N,6-dimethylpyridin-2-amine
CID 123389568
N'-[6-(3-bromo-4-methoxyphenyl)pyridazin-3-yl]-N-methylethane-1,2-diamine
CID 116970469
N-methyl-6-(6-methylnaphthalen-2-yl)pyridazin-3-amine
CID 116973158
6-(3,4-dimethoxyphenyl)pyridazine-3-carbaldehyde
CID 82294072
N-benzyl-6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-amine
CID 19385488
6-(3-bromo-4-fluorophenyl)-N-methylpyridazin-3-amine
CID 62914654
6-(2-methoxy-4-propan-2-ylphenyl)-N-methylpyridazin-3-amine
CID 82483067
2-[[6-(3-bromo-4-methoxyphenyl)pyridazin-3-yl]amino]acetonitrile
CID 116971838
N-cyclopropyl-6-(3,4,5-trimethoxyphenyl)pyridazin-3-amine
CID 74249111
6-[3-fluoro-4-(trifluoromethyl)phenyl]-N-methylpyridazin-3-amine
CID 107290472
2-[[6-(3-bromo-4-methoxyphenyl)pyridazin-3-yl]amino]ethanol
CID 116971250

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine?
The IUPAC name of 6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine (CID 62203035) is 6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine.
What is the SMILES notation for 6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine?
The canonical SMILES for 6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine is CNc1ccc(-c2ccc(OC)c(OC)c2)nn1.
What is the InChIKey of 6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine?
The InChIKey is BKPCCABNKCREDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-14-13-7-5-10(15-16-13)9-4-6-11(17-2)12(8-9)18-3/h4-8H,1-3H3,(H,14,16).
What are the key properties of 6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine?
6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine has a molecular weight of 245.28 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine is sourced from PubChem (CID 62203035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).