[2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine

C16H28N4O — CID 116777584

IUPAC[2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCCOC(c1nc(NN)cc(C(C)C)n1)C1CCCCC1
InChIInChI=1S/C16H28N4O/c1-4-21-15(12-8-6-5-7-9-12)16-18-13(11(2)3)10-14(19-16)20-17/h10-12,15H,4-9,17H2,1-3H3,(H,18,19,20)
InChIKeyZIUSLTDUPAJWSL-UHFFFAOYSA-N
MW292.43 g/mol
LogP3.54
Rot. Bonds6

About [2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine

[2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 116777584) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is [2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID116777584
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name[2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCCOC(c1nc(NN)cc(C(C)C)n1)C1CCCCC1
InChIInChI=1S/C16H28N4O/c1-4-21-15(12-8-6-5-7-9-12)16-18-13(11(2)3)10-14(19-16)20-17/h10-12,15H,4-9,17H2,1-3H3,(H,18,19,20)
InChIKeyZIUSLTDUPAJWSL-UHFFFAOYSA-N
XLogP3.54
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
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-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 116730346
[2-[cyclohexyl(ethoxy)methyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 116777479
6-cyclopentyl-2-[cyclopropyl(ethoxy)methyl]-N-methylpyrimidin-4-amine
CID 116730104
[6-tert-butyl-2-[cyclohexyl(methoxy)methyl]pyrimidin-4-yl]hydrazine
CID 116777556
N-cyclooctyl-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80968823
2-[cyclohexyl(ethoxy)methyl]-6-ethyl-5-methylpyrimidin-4-amine
CID 116776337
4-tert-butyl-6-chloro-2-[cyclohexyl(ethoxy)methyl]pyrimidine
CID 116745713
[6-propan-2-yl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]hydrazine
CID 65400565
N-(1-cyclohexylethyl)-2-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80936916
1-[2-[cyclohexyl(ethoxy)methyl]-4-methylpyrimidin-5-yl]-N-methylethanamine
CID 116778896
N-[[2-[cyclohexyl(ethoxy)methyl]pyrimidin-4-yl]methyl]propan-2-amine
CID 116778533
2-[cyclopropyl(ethoxy)methyl]-N-ethyl-6-propylpyrimidin-4-amine
CID 116728820

Frequently Asked Questions

What is the IUPAC name of [2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine (CID 116777584) is [2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine is CCOC(c1nc(NN)cc(C(C)C)n1)C1CCCCC1.
What is the InChIKey of [2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is ZIUSLTDUPAJWSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-4-21-15(12-8-6-5-7-9-12)16-18-13(11(2)3)10-14(19-16)20-17/h10-12,15H,4-9,17H2,1-3H3,(H,18,19,20).
What are the key properties of [2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine?
[2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 292.43 g/mol, XLogP of 3.54, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 116777584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).