[2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine

C16H20N4 — CID 79980375

IUPAC[2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine
SMILESCCc1nc(-c2ccc(C3CC3)cc2)nc(NN)c1C
InChIInChI=1S/C16H20N4/c1-3-14-10(2)15(20-17)19-16(18-14)13-8-6-12(7-9-13)11-4-5-11/h6-9,11H,3-5,17H2,1-2H3,(H,18,19,20)
InChIKeyGMELRCXALIRRIK-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.18
Rot. Bonds4

About [2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine

[2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine (PubChem CID 79980375) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is [2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine
PubChem CID79980375
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name[2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine
SMILESCCc1nc(-c2ccc(C3CC3)cc2)nc(NN)c1C
InChIInChI=1S/C16H20N4/c1-3-14-10(2)15(20-17)19-16(18-14)13-8-6-12(7-9-13)11-4-5-11/h6-9,11H,3-5,17H2,1-2H3,(H,18,19,20)
InChIKeyGMELRCXALIRRIK-UHFFFAOYSA-N
XLogP3.18
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine (CID 79980375) is [2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine is CCc1nc(-c2ccc(C3CC3)cc2)nc(NN)c1C.
What is the InChIKey of [2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine?
The InChIKey is GMELRCXALIRRIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-3-14-10(2)15(20-17)19-16(18-14)13-8-6-12(7-9-13)11-4-5-11/h6-9,11H,3-5,17H2,1-2H3,(H,18,19,20).
What are the key properties of [2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine?
[2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine has a molecular weight of 268.36 g/mol, XLogP of 3.18, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-cyclopropylphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 79980375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).