[6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine

C13H18N4O — CID 104790765

IUPAC[6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1nc(-c2ccoc2C)nc(NN)c1C(C)C
InChIInChI=1S/C13H18N4O/c1-7(2)11-8(3)15-12(16-13(11)17-14)10-5-6-18-9(10)4/h5-7H,14H2,1-4H3,(H,15,16,17)
InChIKeyJPSCPCJZJATWLE-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.76
Rot. Bonds3

About [6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine

[6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 104790765) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is [6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID104790765
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name[6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1nc(-c2ccoc2C)nc(NN)c1C(C)C
InChIInChI=1S/C13H18N4O/c1-7(2)11-8(3)15-12(16-13(11)17-14)10-5-6-18-9(10)4/h5-7H,14H2,1-4H3,(H,15,16,17)
InChIKeyJPSCPCJZJATWLE-UHFFFAOYSA-N
XLogP2.76
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[4,6-dimethyl-2-(2-methylfuran-3-yl)pyrimidin-5-yl]-N-methylpropan-1-amine
CID 104790877
[2-(2-methylfuran-3-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 104790753
[2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine
CID 62916072
2-[4,6-dimethyl-2-(2-methylfuran-3-yl)pyrimidin-5-yl]propanoic acid
CID 104790501
[6-methyl-2-(3-methyl-2-pyridinyl)-5-propan-2-ylpyrimidin-4-yl]hydrazine
CID 62915348
N-ethyl-5,6-dimethyl-2-(2-methylfuran-3-yl)pyrimidin-4-amine
CID 104790643
4-(2-methylfuran-3-yl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 104791064
[6-methyl-5-propan-2-yl-2-(3,4,5-trifluorophenyl)pyrimidin-4-yl]hydrazine
CID 62915530
[6-methyl-2,5-di(propan-2-yl)pyrimidin-4-yl]hydrazine
CID 62915894
3-[4,6-dimethyl-2-(2-methylfuran-3-yl)pyrimidin-5-yl]-N-methylpropan-1-amine
CID 104790857
N-ethyl-2-(2-methylfuran-3-yl)-6-propan-2-ylpyrimidin-4-amine
CID 113453441
[6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine
CID 62915531

Frequently Asked Questions

What is the IUPAC name of [6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine (CID 104790765) is [6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine is Cc1nc(-c2ccoc2C)nc(NN)c1C(C)C.
What is the InChIKey of [6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is JPSCPCJZJATWLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-7(2)11-8(3)15-12(16-13(11)17-14)10-5-6-18-9(10)4/h5-7H,14H2,1-4H3,(H,15,16,17).
What are the key properties of [6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine?
[6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 246.31 g/mol, XLogP of 2.76, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-2-(2-methylfuran-3-yl)-5-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 104790765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).