6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine

C11H14N4O — CID 62301068

IUPAC6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine
SMILESCN(Cc1ccco1)c1ccc(CN)nn1
InChIInChI=1S/C11H14N4O/c1-15(8-10-3-2-6-16-10)11-5-4-9(7-12)13-14-11/h2-6H,7-8,12H2,1H3
InChIKeyVIHXHYMCCXSHPG-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.16
Rot. Bonds4

About 6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine

6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine (PubChem CID 62301068) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine
PubChem CID62301068
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine
SMILESCN(Cc1ccco1)c1ccc(CN)nn1
InChIInChI=1S/C11H14N4O/c1-15(8-10-3-2-6-16-10)11-5-4-9(7-12)13-14-11/h2-6H,7-8,12H2,1H3
InChIKeyVIHXHYMCCXSHPG-UHFFFAOYSA-N
XLogP1.16
TPSA68.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine?
The IUPAC name of 6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine (CID 62301068) is 6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine.
What is the SMILES notation for 6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine?
The canonical SMILES for 6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine is CN(Cc1ccco1)c1ccc(CN)nn1.
What is the InChIKey of 6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine?
The InChIKey is VIHXHYMCCXSHPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-15(8-10-3-2-6-16-10)11-5-4-9(7-12)13-14-11/h2-6H,7-8,12H2,1H3.
What are the key properties of 6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine?
6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine has a molecular weight of 218.26 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine is sourced from PubChem (CID 62301068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).