[1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol

C14H23NO2 — CID 81412953

IUPAC[1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol
SMILESOCC1(CNCCc2ccco2)CCCCC1
InChIInChI=1S/C14H23NO2/c16-12-14(7-2-1-3-8-14)11-15-9-6-13-5-4-10-17-13/h4-5,10,15-16H,1-3,6-9,11-12H2
InChIKeyXQQKIMGZENVBGM-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.35
Rot. Bonds6

About [1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol

[1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol (PubChem CID 81412953) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is [1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol
PubChem CID81412953
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name[1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol
SMILESOCC1(CNCCc2ccco2)CCCCC1
InChIInChI=1S/C14H23NO2/c16-12-14(7-2-1-3-8-14)11-15-9-6-13-5-4-10-17-13/h4-5,10,15-16H,1-3,6-9,11-12H2
InChIKeyXQQKIMGZENVBGM-UHFFFAOYSA-N
XLogP2.35
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

[1-[(2-phenylethylamino)methyl]cyclohexyl]methanol
CID 81411898
[1-[[2-(5-methylfuran-2-yl)ethylamino]methyl]cyclobutyl]methanol
CID 115247111
2-(furan-2-yl)-N-[(3-propylpyrrolidin-3-yl)methyl]ethanamine
CID 63142896
[1-[[2-(5-methylfuran-2-yl)ethylamino]methyl]cyclopropyl]methanol
CID 115243693
[1-[[2-(5-bromothiophen-2-yl)ethylamino]methyl]cyclohexyl]methanol
CID 106042522
N-(furan-2-ylmethyl)-2-[[1-(hydroxymethyl)cyclohexyl]methylamino]propanamide
CID 103966369
1-[2-[2-(furan-2-yl)ethylamino]-2-oxoethyl]cycloheptane-1-carboxylic acid
CID 60941221
N-[[1-(furan-2-ylmethyl)cyclohexyl]methyl]-2-methylpropan-1-amine
CID 63000497
4-[1-[[2-(furan-2-yl)ethylamino]methyl]cyclopropyl]aniline
CID 112558089
(3S)-3-[[2-(furan-2-yl)ethylamino]methyl]-3-hydroxy-1-(2-phenylethyl)piperidin-2-one
CID 95206186
[1-[[2-(4-fluoro-2-methylphenyl)ethylamino]methyl]cyclohexyl]methanol
CID 81418469
1-(furan-2-yl)-2-[[1-(hydroxymethyl)cyclopropyl]methylamino]ethanol
CID 115454702

Frequently Asked Questions

What is the IUPAC name of [1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol (CID 81412953) is [1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol is OCC1(CNCCc2ccco2)CCCCC1.
What is the InChIKey of [1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol?
The InChIKey is XQQKIMGZENVBGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c16-12-14(7-2-1-3-8-14)11-15-9-6-13-5-4-10-17-13/h4-5,10,15-16H,1-3,6-9,11-12H2.
What are the key properties of [1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol?
[1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol has a molecular weight of 237.34 g/mol, XLogP of 2.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[2-(furan-2-yl)ethylamino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 81412953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).