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

C16H28N4O — CID 81001433

IUPAC[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCCC1CCCC(Oc2nc(C(C)C)nc(NN)c2C)C1
InChIInChI=1S/C16H28N4O/c1-5-12-7-6-8-13(9-12)21-16-11(4)15(20-17)18-14(19-16)10(2)3/h10,12-13H,5-9,17H2,1-4H3,(H,18,19,20)
InChIKeyBSHZOXNINRYSKN-UHFFFAOYSA-N
MW292.43 g/mol
LogP3.54
Rot. Bonds5

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

[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 81001433) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID81001433
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCCC1CCCC(Oc2nc(C(C)C)nc(NN)c2C)C1
InChIInChI=1S/C16H28N4O/c1-5-12-7-6-8-13(9-12)21-16-11(4)15(20-17)18-14(19-16)10(2)3/h10,12-13H,5-9,17H2,1-4H3,(H,18,19,20)
InChIKeyBSHZOXNINRYSKN-UHFFFAOYSA-N
XLogP3.54
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 53.54
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-cyclopropyl-6-(3-ethylcyclohexyl)oxy-5-methylpyrimidin-4-yl]hydrazine
CID 81001434
[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine
CID 81001432
[5-methyl-6-(4-methylcyclohexyl)oxy-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 81001712
[6-(4,4-dimethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 114343032
[5-methyl-6-(1-methylpiperidin-4-yl)oxy-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 81001207
[6-(3-ethylcyclohexyl)oxy-5-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80922282
6-(3-methoxycyclohexyl)oxy-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
CID 80990384
[2-ethyl-6-(3-methoxycyclohexyl)oxy-5-methylpyrimidin-4-yl]hydrazine
CID 81000204
6-(3-ethylcyclohexyl)oxy-N,5-dimethylpyrimidin-4-amine
CID 80876542
[5-methyl-6-(oxolan-3-ylmethoxy)-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 81001634
4-chloro-6-(3-ethylcyclohexyl)oxy-2-propan-2-ylpyrimidine
CID 80949334
N-(cyclopropylmethyl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 81001481

Frequently Asked Questions

What is the IUPAC name of [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine (CID 81001433) is [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine is CCC1CCCC(Oc2nc(C(C)C)nc(NN)c2C)C1.
What is the InChIKey of [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is BSHZOXNINRYSKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-5-12-7-6-8-13(9-12)21-16-11(4)15(20-17)18-14(19-16)10(2)3/h10,12-13H,5-9,17H2,1-4H3,(H,18,19,20).
What are the key properties of [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine?
[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 292.43 g/mol, XLogP of 3.54, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 81001433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).