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

C13H20N4O — CID 80968842

IUPAC(6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine
SMILESNNc1cc(OC2CCCCC2)nc(C2CC2)n1
InChIInChI=1S/C13H20N4O/c14-17-11-8-12(16-13(15-11)9-6-7-9)18-10-4-2-1-3-5-10/h8-10H,1-7,14H2,(H,15,16,17)
InChIKeyDREUONDTVYGCLN-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.35
Rot. Bonds4

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

(6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine (PubChem CID 80968842) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is (6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine
PubChem CID80968842
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name(6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine
SMILESNNc1cc(OC2CCCCC2)nc(C2CC2)n1
InChIInChI=1S/C13H20N4O/c14-17-11-8-12(16-13(15-11)9-6-7-9)18-10-4-2-1-3-5-10/h8-10H,1-7,14H2,(H,15,16,17)
InChIKeyDREUONDTVYGCLN-UHFFFAOYSA-N
XLogP2.35
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.35
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-cyclopropylpyrimidin-4-yl)hydrazine?
The IUPAC name of (6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine (CID 80968842) is (6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine is NNc1cc(OC2CCCCC2)nc(C2CC2)n1.
What is the InChIKey of (6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine?
The InChIKey is DREUONDTVYGCLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c14-17-11-8-12(16-13(15-11)9-6-7-9)18-10-4-2-1-3-5-10/h8-10H,1-7,14H2,(H,15,16,17).
What are the key properties of (6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine?
(6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine has a molecular weight of 248.33 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-cyclohexyloxy-2-cyclopropylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 80968842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).