6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine

C16H20N4O — CID 62282714

IUPAC6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine
SMILESCOc1ccccc1N(C)c1ccc(CNC2CC2)nn1
InChIInChI=1S/C16H20N4O/c1-20(14-5-3-4-6-15(14)21-2)16-10-9-13(18-19-16)11-17-12-7-8-12/h3-6,9-10,12,17H,7-8,11H2,1-2H3
InChIKeyJVKWKYHRLYQUKI-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.51
Rot. Bonds6

About 6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine

6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine (PubChem CID 62282714) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine.

Molecular Properties

Compound Name6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine
PubChem CID62282714
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine
SMILESCOc1ccccc1N(C)c1ccc(CNC2CC2)nn1
InChIInChI=1S/C16H20N4O/c1-20(14-5-3-4-6-15(14)21-2)16-10-9-13(18-19-16)11-17-12-7-8-12/h3-6,9-10,12,17H,7-8,11H2,1-2H3
InChIKeyJVKWKYHRLYQUKI-UHFFFAOYSA-N
XLogP2.51
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[3-[(cyclopropylamino)methyl]-1,2-oxazol-5-yl]methyl]-2-methoxy-N-methylaniline
CID 62429145
N-cyclopropyl-2-ethyl-N'-(2-methoxyphenyl)-N',2-dimethylpropane-1,3-diamine
CID 62260608
N-cyclopropyl-2,2-diethyl-N'-(2-methoxyphenyl)-N'-methylpropane-1,3-diamine
CID 62259922
6-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-pentan-3-ylpyridazin-3-amine
CID 62289414
5-[(cyclopropylamino)methyl]-N-(2-fluorophenyl)-N-methylpyrazin-2-amine
CID 107379625
6-[(cyclopropylamino)methyl]-N-(2-fluorophenyl)-N-methylpyridin-2-amine
CID 62294639
N-[[2-[(cyclopropylamino)methyl]furan-3-yl]methyl]-2-methoxy-N-methylaniline
CID 62428787
N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 62555730
N-[[6-(2-methylsulfanylphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
CID 63647201
6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine
CID 62279754
N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
CID 62323240
N-[[6-(2-methoxy-4-methylphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
CID 62297563

Frequently Asked Questions

What is the IUPAC name of 6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine?
The IUPAC name of 6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine (CID 62282714) is 6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine.
What is the SMILES notation for 6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine?
The canonical SMILES for 6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine is COc1ccccc1N(C)c1ccc(CNC2CC2)nn1.
What is the InChIKey of 6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine?
The InChIKey is JVKWKYHRLYQUKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-20(14-5-3-4-6-15(14)21-2)16-10-9-13(18-19-16)11-17-12-7-8-12/h3-6,9-10,12,17H,7-8,11H2,1-2H3.
What are the key properties of 6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine?
6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine has a molecular weight of 284.36 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(cyclopropylamino)methyl]-N-(2-methoxyphenyl)-N-methylpyridazin-3-amine is sourced from PubChem (CID 62282714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).