2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one

C10H10N4O2 — CID 135439368

IUPAC2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one
SMILESCc1cc(=O)[nH]c(NN=Cc2ccco2)n1
InChIInChI=1S/C10H10N4O2/c1-7-5-9(15)13-10(12-7)14-11-6-8-3-2-4-16-8/h2-6H,1H3,(H2,12,13,14,15)
InChIKeyYZMFOBBCRBZZMU-UHFFFAOYSA-N
MW218.22 g/mol
LogP1.12
Rot. Bonds3

About 2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one

2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one (PubChem CID 135439368) has the molecular formula C10H10N4O2 and a molecular weight of 218.22 g/mol. Its IUPAC name is 2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one
PubChem CID135439368
Molecular FormulaC10H10N4O2
Molecular Weight218.22 g/mol
Exact Mass218.08
IUPAC Name2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one
SMILESCc1cc(=O)[nH]c(NN=Cc2ccco2)n1
InChIInChI=1S/C10H10N4O2/c1-7-5-9(15)13-10(12-7)14-11-6-8-3-2-4-16-8/h2-6H,1H3,(H2,12,13,14,15)
InChIKeyYZMFOBBCRBZZMU-UHFFFAOYSA-N
XLogP1.12
TPSA83.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-(Furan-2-ylmethylene)hydrazinyl)-6-methylpyrimidin-4-ol
CID 135454397
2-Furaldehyde (6-methyl-3-oxo-2,3-dihydro-1,2,4-triazin-5-yl)hydrazone
CID 9582651
(E)-5-(2-(furan-2-ylmethylene)hydrazinyl)-1,2,4-triazin-3(2H)-one
CID 9640232
4-[(E)-furan-2-ylmethylideneamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one
CID 5342477
6-Methyl-2-[(2E)-2-[(5-methylfuran-2-YL)methylidene]hydrazin-1-YL]-3,4-dihydropyrimidin-4-one
CID 135476878
(4Z)-4-(furan-2-ylmethylidene)-2-[(2E)-2-(2,3,4,5-tetrahydroxypentylidene)hydrazinyl]-1H-imidazol-5-one
CID 135505209
(5Z)-4-ethyl-5-(furan-2-ylmethylidene)-N-[(E)-furan-2-ylmethylideneamino]imidazol-2-amine
CID 9556339
4-[(E)-furan-2-ylmethylideneamino]-3-methyl-1H-1,2,4-triazol-5-one
CID 9556340
(5E)-4-ethyl-5-(2-furylmethylene)-N-[(E)-2-furylmethyleneamino]imidazol-2-amine
CID 9575073
(4Z)-2-[(2E)-2-benzylidenehydrazinyl]-4-(furan-2-ylmethylidene)-1H-imidazol-5-one
CID 135450762
(4Z)-4-(2-furylmethylene)-2-hydrazino-1H-imidazol-5-one
CID 135494002
5-fluoro-6-[(2E)-2-(furan-2-ylmethylidene)hydrazinyl]-1H-pyrimidin-2-one
CID 59160692

Frequently Asked Questions

What is the IUPAC name of 2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one?
The IUPAC name of 2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one (CID 135439368) is 2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one?
The canonical SMILES for 2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one is Cc1cc(=O)[nH]c(NN=Cc2ccco2)n1.
What is the InChIKey of 2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one?
The InChIKey is YZMFOBBCRBZZMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2/c1-7-5-9(15)13-10(12-7)14-11-6-8-3-2-4-16-8/h2-6H,1H3,(H2,12,13,14,15).
What are the key properties of 2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one?
2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one has a molecular weight of 218.22 g/mol, XLogP of 1.12, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(furan-2-ylmethylidene)hydrazinyl]-4-methyl-1H-pyrimidin-6-one is sourced from PubChem (CID 135439368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).