N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine

C14H15N5O — CID 56759811

IUPACN-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine
SMILESCN(Cc1ccco1)c1ccc(-c2nccn2C)nn1
InChIInChI=1S/C14H15N5O/c1-18-8-7-15-14(18)12-5-6-13(17-16-12)19(2)10-11-4-3-9-20-11/h3-9H,10H2,1-2H3
InChIKeyCJODTAJEXHGLBT-UHFFFAOYSA-N
MW269.31 g/mol
LogP2.11
Rot. Bonds4

About N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine

N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine (PubChem CID 56759811) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine
PubChem CID56759811
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC NameN-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine
SMILESCN(Cc1ccco1)c1ccc(-c2nccn2C)nn1
InChIInChI=1S/C14H15N5O/c1-18-8-7-15-14(18)12-5-6-13(17-16-12)19(2)10-11-4-3-9-20-11/h3-9H,10H2,1-2H3
InChIKeyCJODTAJEXHGLBT-UHFFFAOYSA-N
XLogP2.11
TPSA59.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine?
The IUPAC name of N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine (CID 56759811) is N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine?
The canonical SMILES for N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine is CN(Cc1ccco1)c1ccc(-c2nccn2C)nn1.
What is the InChIKey of N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine?
The InChIKey is CJODTAJEXHGLBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O/c1-18-8-7-15-14(18)12-5-6-13(17-16-12)19(2)10-11-4-3-9-20-11/h3-9H,10H2,1-2H3.
What are the key properties of N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine?
N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine has a molecular weight of 269.31 g/mol, XLogP of 2.11, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-methyl-6-(1-methylimidazol-2-yl)pyridazin-3-amine is sourced from PubChem (CID 56759811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).