N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine

C11H14N4O — CID 116970435

IUPACN'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine
SMILESCc1ccc(-c2ccc(NCCN)nn2)o1
InChIInChI=1S/C11H14N4O/c1-8-2-4-10(16-8)9-3-5-11(15-14-9)13-7-6-12/h2-5H,6-7,12H2,1H3,(H,13,15)
InChIKeyKRFCKJCSWCQVQF-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.42
Rot. Bonds4

About N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine

N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine (PubChem CID 116970435) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine
PubChem CID116970435
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC NameN'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine
SMILESCc1ccc(-c2ccc(NCCN)nn2)o1
InChIInChI=1S/C11H14N4O/c1-8-2-4-10(16-8)9-3-5-11(15-14-9)13-7-6-12/h2-5H,6-7,12H2,1H3,(H,13,15)
InChIKeyKRFCKJCSWCQVQF-UHFFFAOYSA-N
XLogP1.42
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine?
The IUPAC name of N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine (CID 116970435) is N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine.
What is the SMILES notation for N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine?
The canonical SMILES for N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine is Cc1ccc(-c2ccc(NCCN)nn2)o1.
What is the InChIKey of N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine?
The InChIKey is KRFCKJCSWCQVQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-8-2-4-10(16-8)9-3-5-11(15-14-9)13-7-6-12/h2-5H,6-7,12H2,1H3,(H,13,15).
What are the key properties of N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine?
N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine has a molecular weight of 218.26 g/mol, XLogP of 1.42, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine is sourced from PubChem (CID 116970435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).