[2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol

C15H29NO2 — CID 106359606

IUPAC[2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol
SMILESCCC1(C)CC(NC2CCCCC2CO)CCO1
InChIInChI=1S/C15H29NO2/c1-3-15(2)10-13(8-9-18-15)16-14-7-5-4-6-12(14)11-17/h12-14,16-17H,3-11H2,1-2H3
InChIKeyUFADBGCVYMKXCF-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.47
Rot. Bonds4

About [2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol

[2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol (PubChem CID 106359606) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is [2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol
PubChem CID106359606
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name[2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol
SMILESCCC1(C)CC(NC2CCCCC2CO)CCO1
InChIInChI=1S/C15H29NO2/c1-3-15(2)10-13(8-9-18-15)16-14-7-5-4-6-12(14)11-17/h12-14,16-17H,3-11H2,1-2H3
InChIKeyUFADBGCVYMKXCF-UHFFFAOYSA-N
XLogP2.47
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(Cyclohexylmethylamino)cyclohexyl]ethanol
CID 164681336
2-ethyl-2-methyl-N-[2-(trifluoromethyl)cyclohexyl]oxan-4-amine
CID 64101537
2,2-diethyl-N-[2-(trifluoromethyl)cyclohexyl]oxan-4-amine
CID 83036014
3-[(2-Ethyl-2-methyloxan-4-yl)amino]-2,2-difluoropropan-1-ol
CID 106172878
2,2-Difluoro-3-(1-oxaspiro[5.5]undecan-4-ylamino)propan-1-ol
CID 106176373
[(1S,2S)-2-(methylamino)cyclohexyl]methanol
CID 12167496
[2-(Methylamino)cyclohexyl]methanol
CID 12651719
[(1S,2R)-2-(methylamino)cyclohexyl]methanol
CID 12651720
[(1R,2R)-2-(methylamino)cyclohexyl]methanol
CID 12651721
[2-(Propylamino)cyclohexyl]methanol
CID 57577782
[2-(Tert-butylamino)cyclohexyl]methanol
CID 58109888
Rel-((1R,2S)-2-(methylamino)cyclohexyl)methanol
CID 58168913

Frequently Asked Questions

What is the IUPAC name of [2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol?
The IUPAC name of [2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol (CID 106359606) is [2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol?
The canonical SMILES for [2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol is CCC1(C)CC(NC2CCCCC2CO)CCO1.
What is the InChIKey of [2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol?
The InChIKey is UFADBGCVYMKXCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-3-15(2)10-13(8-9-18-15)16-14-7-5-4-6-12(14)11-17/h12-14,16-17H,3-11H2,1-2H3.
What are the key properties of [2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol?
[2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol has a molecular weight of 255.40 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-ethyl-2-methyloxan-4-yl)amino]cyclohexyl]methanol is sourced from PubChem (CID 106359606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).