(6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine

C14H16N4 — CID 767033

IUPAC(6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine
SMILESC=CCc1c(C)nc(-c2ccccc2)nc1NN
InChIInChI=1S/C14H16N4/c1-3-7-12-10(2)16-13(17-14(12)18-15)11-8-5-4-6-9-11/h3-6,8-9H,1,7,15H2,2H3,(H,16,17,18)
InChIKeyCMAOOHBCBYOSHV-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.47
Rot. Bonds4

About (6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine

(6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine (PubChem CID 767033) has the molecular formula C14H16N4 and a molecular weight of 240.31 g/mol. Its IUPAC name is (6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine
PubChem CID767033
Molecular FormulaC14H16N4
Molecular Weight240.31 g/mol
Exact Mass240.14
IUPAC Name(6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine
SMILESC=CCc1c(C)nc(-c2ccccc2)nc1NN
InChIInChI=1S/C14H16N4/c1-3-7-12-10(2)16-13(17-14(12)18-15)11-8-5-4-6-9-11/h3-6,8-9H,1,7,15H2,2H3,(H,16,17,18)
InChIKeyCMAOOHBCBYOSHV-UHFFFAOYSA-N
XLogP2.47
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 (6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine?
The IUPAC name of (6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine (CID 767033) is (6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine is C=CCc1c(C)nc(-c2ccccc2)nc1NN.
What is the InChIKey of (6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine?
The InChIKey is CMAOOHBCBYOSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4/c1-3-7-12-10(2)16-13(17-14(12)18-15)11-8-5-4-6-9-11/h3-6,8-9H,1,7,15H2,2H3,(H,16,17,18).
What are the key properties of (6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine?
(6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine has a molecular weight of 240.31 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 767033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).