N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine

C13H18N4O — CID 62280117

IUPACN-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine
SMILESCNCc1ccc(N(C)Cc2ccc(C)o2)nn1
InChIInChI=1S/C13H18N4O/c1-10-4-6-12(18-10)9-17(3)13-7-5-11(8-14-2)15-16-13/h4-7,14H,8-9H2,1-3H3
InChIKeyAGEDVSJWXBPHMF-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.73
Rot. Bonds5

About N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine

N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine (PubChem CID 62280117) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine
PubChem CID62280117
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC NameN-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine
SMILESCNCc1ccc(N(C)Cc2ccc(C)o2)nn1
InChIInChI=1S/C13H18N4O/c1-10-4-6-12(18-10)9-17(3)13-7-5-11(8-14-2)15-16-13/h4-7,14H,8-9H2,1-3H3
InChIKeyAGEDVSJWXBPHMF-UHFFFAOYSA-N
XLogP1.73
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-6-(methylaminomethyl)pyridazin-3-amine
CID 62280865
N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine
CID 62289611
N-[(2-bromophenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridazin-3-amine
CID 55059071
6-[methyl-[(5-methylfuran-2-yl)methyl]amino]pyridine-3-carbaldehyde
CID 80637621
2-N,6-N-dimethyl-6-N-[(5-methylfuran-2-yl)methyl]pyridine-2,6-diamine
CID 80781469
N-methyl-N-[(5-methylfuran-2-yl)methyl]-5-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62280275
N,3-dimethyl-5-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine
CID 80630644
N,3-dimethyl-4-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]aniline
CID 62135016
N-methyl-N-[(5-methylfuran-2-yl)methyl]-6-(propylaminomethyl)pyridin-2-amine
CID 62280099
N,N'-dimethyl-N'-[(5-methylfuran-2-yl)methyl]ethane-1,2-diamine
CID 43526366
[6-[methyl-[(5-methylfuran-2-yl)methyl]amino]pyrazin-2-yl]methanol
CID 66466599
6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine
CID 62301068

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine?
The IUPAC name of N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine (CID 62280117) is N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine.
What is the SMILES notation for N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine?
The canonical SMILES for N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine is CNCc1ccc(N(C)Cc2ccc(C)o2)nn1.
What is the InChIKey of N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine?
The InChIKey is AGEDVSJWXBPHMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-10-4-6-12(18-10)9-17(3)13-7-5-11(8-14-2)15-16-13/h4-7,14H,8-9H2,1-3H3.
What are the key properties of N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine?
N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine has a molecular weight of 246.31 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine is sourced from PubChem (CID 62280117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).