1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine

C15H31NO — CID 116771942

IUPAC1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine
SMILESCCOC(C(N)CCC(C)C)C1CCCCC1
InChIInChI=1S/C15H31NO/c1-4-17-15(13-8-6-5-7-9-13)14(16)11-10-12(2)3/h12-15H,4-11,16H2,1-3H3
InChIKeyLIZRESYUENLFIR-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.74
Rot. Bonds7

About 1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine

1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine (PubChem CID 116771942) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine
PubChem CID116771942
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine
SMILESCCOC(C(N)CCC(C)C)C1CCCCC1
InChIInChI=1S/C15H31NO/c1-4-17-15(13-8-6-5-7-9-13)14(16)11-10-12(2)3/h12-15H,4-11,16H2,1-3H3
InChIKeyLIZRESYUENLFIR-UHFFFAOYSA-N
XLogP3.74
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-1-ethoxy-3-methylhexan-2-amine
CID 107896950
1-cyclohexyl-1-ethoxy-3,5-dimethylhexan-2-amine
CID 114284903
1-cyclopropyl-1-ethoxynonan-2-amine
CID 116723047
2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol
CID 116756693
[(1S)-1-ethoxyethyl]cyclohexane
CID 59678198
1-cyclohexyl-3-(2,6-dimethylphenyl)-1-ethoxypropan-2-amine
CID 116772041
(1-cyclohexyl-3-cyclopentyl-1-ethoxypropan-2-yl)hydrazine
CID 105278814
(1-cyclohexyl-2-cyclopropyl-2-ethoxyethyl)hydrazine
CID 105273087
1-cyclohexyl-1-ethoxy-3-(1-propan-2-ylpyrazol-3-yl)propan-2-amine
CID 116772099
1-cycloheptyl-2-ethoxypropan-1-ol
CID 82931092
1,1-diethoxypropan-2-ylcyclohexane
CID 14745336
(1-cyclohexyl-1-ethoxy-5-methoxy-3-methylpentan-2-yl)hydrazine
CID 105278797

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine?
The IUPAC name of 1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine (CID 116771942) is 1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine.
What is the SMILES notation for 1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine?
The canonical SMILES for 1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine is CCOC(C(N)CCC(C)C)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine?
The InChIKey is LIZRESYUENLFIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-4-17-15(13-8-6-5-7-9-13)14(16)11-10-12(2)3/h12-15H,4-11,16H2,1-3H3.
What are the key properties of 1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine?
1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine has a molecular weight of 241.42 g/mol, XLogP of 3.74, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine is sourced from PubChem (CID 116771942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).