3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile

C10H8N4O — CID 80508635

IUPAC3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile
SMILESN#Cc1ccnnc1NCc1ccco1
InChIInChI=1S/C10H8N4O/c11-6-8-3-4-13-14-10(8)12-7-9-2-1-5-15-9/h1-5H,7H2,(H,12,14)
InChIKeyPTOQQDYEUPSNOC-UHFFFAOYSA-N
MW200.20 g/mol
LogP1.55
Rot. Bonds3

About 3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile

3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile (PubChem CID 80508635) has the molecular formula C10H8N4O and a molecular weight of 200.20 g/mol. Its IUPAC name is 3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile.

Molecular Properties

Compound Name3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile
PubChem CID80508635
Molecular FormulaC10H8N4O
Molecular Weight200.20 g/mol
Exact Mass200.07
IUPAC Name3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile
SMILESN#Cc1ccnnc1NCc1ccco1
InChIInChI=1S/C10H8N4O/c11-6-8-3-4-13-14-10(8)12-7-9-2-1-5-15-9/h1-5H,7H2,(H,12,14)
InChIKeyPTOQQDYEUPSNOC-UHFFFAOYSA-N
XLogP1.55
TPSA74.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.20
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile
CID 62671433
5-bromo-2-(furan-2-ylmethylamino)pyridine-3-carbonitrile
CID 82341774
3-[(2-bromophenyl)methylamino]pyridazine-4-carbonitrile
CID 80510383
4-(furan-2-ylmethylamino)pyridine-2-carbonitrile
CID 62924814
3-(naphthalen-1-ylmethylamino)pyridazine-4-carbonitrile
CID 80509832
N-(furan-2-ylmethyl)pyrimidin-2-amine
CID 28514232
3-(prop-2-ynylamino)pyridazine-4-carbonitrile
CID 80509420
3-(2-phenylethylamino)pyridazine-4-carbonitrile
CID 80509461
5-[[(4-cyanopyridazin-3-yl)amino]methyl]-2-methylfuran-3-carboxylic acid
CID 80508614
3-(1,3-thiazol-4-ylmethylamino)pyridazine-4-carbonitrile
CID 80509682
5-(furan-2-ylmethylamino)-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
CID 137349703
3-[(2-methoxy-3-pyridinyl)methylamino]pyridazine-4-carbonitrile
CID 80515426

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile?
The IUPAC name of 3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile (CID 80508635) is 3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile.
What is the SMILES notation for 3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile?
The canonical SMILES for 3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile is N#Cc1ccnnc1NCc1ccco1.
What is the InChIKey of 3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile?
The InChIKey is PTOQQDYEUPSNOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O/c11-6-8-3-4-13-14-10(8)12-7-9-2-1-5-15-9/h1-5H,7H2,(H,12,14).
What are the key properties of 3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile?
3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile has a molecular weight of 200.20 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile is sourced from PubChem (CID 80508635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).