(6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine

C16H20N4O — CID 115916294

IUPAC(6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine
SMILESNNc1cc(OC2CCCCC2)nc(-c2ccccc2)n1
InChIInChI=1S/C16H20N4O/c17-20-14-11-15(21-13-9-5-2-6-10-13)19-16(18-14)12-7-3-1-4-8-12/h1,3-4,7-8,11,13H,2,5-6,9-10,17H2,(H,18,19,20)
InChIKeySZKOPPFECQPFBI-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.14
Rot. Bonds4

About (6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine

(6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine (PubChem CID 115916294) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is (6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine
PubChem CID115916294
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name(6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine
SMILESNNc1cc(OC2CCCCC2)nc(-c2ccccc2)n1
InChIInChI=1S/C16H20N4O/c17-20-14-11-15(21-13-9-5-2-6-10-13)19-16(18-14)12-7-3-1-4-8-12/h1,3-4,7-8,11,13H,2,5-6,9-10,17H2,(H,18,19,20)
InChIKeySZKOPPFECQPFBI-UHFFFAOYSA-N
XLogP3.14
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.14
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 (6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine?
The IUPAC name of (6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine (CID 115916294) is (6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine is NNc1cc(OC2CCCCC2)nc(-c2ccccc2)n1.
What is the InChIKey of (6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine?
The InChIKey is SZKOPPFECQPFBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c17-20-14-11-15(21-13-9-5-2-6-10-13)19-16(18-14)12-7-3-1-4-8-12/h1,3-4,7-8,11,13H,2,5-6,9-10,17H2,(H,18,19,20).
What are the key properties of (6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine?
(6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine has a molecular weight of 284.36 g/mol, XLogP of 3.14, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-cyclohexyloxy-2-phenylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 115916294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).