(5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine

C16H15N5 — CID 104847099

IUPAC(5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine
SMILESCc1c(NN)nc(-c2cccnc2)nc1-c1ccccc1
InChIInChI=1S/C16H15N5/c1-11-14(12-6-3-2-4-7-12)19-16(20-15(11)21-17)13-8-5-9-18-10-13/h2-10H,17H2,1H3,(H,19,20,21)
InChIKeyOWIGHBLMPXXWGQ-UHFFFAOYSA-N
MW277.33 g/mol
LogP2.80
Rot. Bonds3

About (5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine

(5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine (PubChem CID 104847099) has the molecular formula C16H15N5 and a molecular weight of 277.33 g/mol. Its IUPAC name is (5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine
PubChem CID104847099
Molecular FormulaC16H15N5
Molecular Weight277.33 g/mol
Exact Mass277.13
IUPAC Name(5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine
SMILESCc1c(NN)nc(-c2cccnc2)nc1-c1ccccc1
InChIInChI=1S/C16H15N5/c1-11-14(12-6-3-2-4-7-12)19-16(20-15(11)21-17)13-8-5-9-18-10-13/h2-10H,17H2,1H3,(H,19,20,21)
InChIKeyOWIGHBLMPXXWGQ-UHFFFAOYSA-N
XLogP2.80
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 52.80
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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Frequently Asked Questions

What is the IUPAC name of (5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine?
The IUPAC name of (5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine (CID 104847099) is (5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine is Cc1c(NN)nc(-c2cccnc2)nc1-c1ccccc1.
What is the InChIKey of (5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine?
The InChIKey is OWIGHBLMPXXWGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5/c1-11-14(12-6-3-2-4-7-12)19-16(20-15(11)21-17)13-8-5-9-18-10-13/h2-10H,17H2,1H3,(H,19,20,21).
What are the key properties of (5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine?
(5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine has a molecular weight of 277.33 g/mol, XLogP of 2.80, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-6-phenyl-2-pyridin-3-ylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 104847099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).