(6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine

C12H20N4O — CID 80910051

IUPAC(6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine
SMILESCCc1c(NN)ncnc1OC1CCCCC1
InChIInChI=1S/C12H20N4O/c1-2-10-11(16-13)14-8-15-12(10)17-9-6-4-3-5-7-9/h8-9H,2-7,13H2,1H3,(H,14,15,16)
InChIKeyIYLPCHRWUPPTTN-UHFFFAOYSA-N
MW236.32 g/mol
LogP2.04
Rot. Bonds4

About (6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine

(6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine (PubChem CID 80910051) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is (6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine
PubChem CID80910051
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name(6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine
SMILESCCc1c(NN)ncnc1OC1CCCCC1
InChIInChI=1S/C12H20N4O/c1-2-10-11(16-13)14-8-15-12(10)17-9-6-4-3-5-7-9/h8-9H,2-7,13H2,1H3,(H,14,15,16)
InChIKeyIYLPCHRWUPPTTN-UHFFFAOYSA-N
XLogP2.04
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 52.04
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-5-ethylpyrimidin-4-yl)hydrazine?
The IUPAC name of (6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine (CID 80910051) is (6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine is CCc1c(NN)ncnc1OC1CCCCC1.
What is the InChIKey of (6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine?
The InChIKey is IYLPCHRWUPPTTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-2-10-11(16-13)14-8-15-12(10)17-9-6-4-3-5-7-9/h8-9H,2-7,13H2,1H3,(H,14,15,16).
What are the key properties of (6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine?
(6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine has a molecular weight of 236.32 g/mol, XLogP of 2.04, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 80910051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).