N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine

C15H29NO — CID 113260043

IUPACN-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine
SMILESCC(NCCC1CCCCC1)C1CCOCC1
InChIInChI=1S/C15H29NO/c1-13(15-8-11-17-12-9-15)16-10-7-14-5-3-2-4-6-14/h13-16H,2-12H2,1H3
InChIKeyXZQBIAPDLJOLJV-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.36
Rot. Bonds5

About N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine

N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine (PubChem CID 113260043) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine
PubChem CID113260043
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine
SMILESCC(NCCC1CCCCC1)C1CCOCC1
InChIInChI=1S/C15H29NO/c1-13(15-8-11-17-12-9-15)16-10-7-14-5-3-2-4-6-14/h13-16H,2-12H2,1H3
InChIKeyXZQBIAPDLJOLJV-UHFFFAOYSA-N
XLogP3.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyclobutylethyl)-1-(oxan-4-yl)ethanamine
CID 115893382
N-(1-cyclopentylethyl)-4-(oxan-4-yl)butan-1-amine
CID 114191053
3-cyclohexyl-N-(1-cyclopropylethyl)propan-1-amine
CID 115676362
4-[1-(oxan-4-yl)ethylamino]butan-2-ol
CID 115720280
N-(2-methylsulfanylethyl)-1-(oxan-4-yl)ethanamine
CID 115706242
(1S)-1-cyclohexyl-N-[2-[(2S)-oxolan-2-yl]ethyl]ethanamine
CID 93468404
2-(2-cycloheptylethylamino)propan-1-ol
CID 56854236
1-(oxan-4-yl)-N-[2-(trifluoromethoxy)ethyl]ethanamine
CID 103271280
(1S)-1-cycloheptyl-N-(2-morpholin-4-ylethyl)ethanamine
CID 81393168
4-cyclohexyl-1-(oxan-4-yl)-N-propylbutan-2-amine
CID 115846851
N-(2-cyclopentylethyl)propan-2-amine;molecular hydrogen
CID 165122655
4-methyl-1-[1-(oxan-4-yl)ethylamino]pentan-3-ol
CID 115723515

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine?
The IUPAC name of N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine (CID 113260043) is N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine.
What is the SMILES notation for N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine?
The canonical SMILES for N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine is CC(NCCC1CCCCC1)C1CCOCC1.
What is the InChIKey of N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine?
The InChIKey is XZQBIAPDLJOLJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-13(15-8-11-17-12-9-15)16-10-7-14-5-3-2-4-6-14/h13-16H,2-12H2,1H3.
What are the key properties of N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine?
N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine has a molecular weight of 239.40 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-1-(oxan-4-yl)ethanamine is sourced from PubChem (CID 113260043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).