4-(diethylaminomethyl)cyclohexan-1-ol

C11H23NO — CID 90930897

IUPAC4-(diethylaminomethyl)cyclohexan-1-ol
SMILESCCN(CC)CC1CCC(O)CC1
InChIInChI=1S/C11H23NO/c1-3-12(4-2)9-10-5-7-11(13)8-6-10/h10-11,13H,3-9H2,1-2H3
InChIKeyZHWWGKMUWDPKMK-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.88
Rot. Bonds4

About 4-(diethylaminomethyl)cyclohexan-1-ol

4-(diethylaminomethyl)cyclohexan-1-ol (PubChem CID 90930897) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 4-(diethylaminomethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(diethylaminomethyl)cyclohexan-1-ol
PubChem CID90930897
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name4-(diethylaminomethyl)cyclohexan-1-ol
SMILESCCN(CC)CC1CCC(O)CC1
InChIInChI=1S/C11H23NO/c1-3-12(4-2)9-10-5-7-11(13)8-6-10/h10-11,13H,3-9H2,1-2H3
InChIKeyZHWWGKMUWDPKMK-UHFFFAOYSA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-((Dimethylamino)methyl)cyclohexanol
CID 368214
1-(1-Propylpiperidin-3-yl)ethan-1-ol
CID 21317077
[(1S,3S)-3-hydroxycyclohexyl]methyl-trimethylazanium iodide
CID 118719148
[(1S,3R)-3-hydroxycyclohexyl]methyl-trimethylazanium iodide
CID 118719150
(2-Hydroxycyclohexyl)methyl-trimethylazanium iodide
CID 368215
cis-(1R,2S)-2-[(dimethylamino)methyl]cyclohexan-1-ol
CID 1542462
rel-(1R,2R)-2-((Dimethylamino)methyl)cyclohexanol
CID 1542464
(2R)-5-(diethylamino)-2-ethylpentan-1-ol
CID 10987021
(2-Hydroxycyclohexyl)methyl-trimethylazanium
CID 368216
3-Fluoro-4-(1-methylpyrrolidin-3-yl)butan-2-ol
CID 105436251
1-Fluoro-1-(1-methylpiperidin-4-yl)propan-2-ol
CID 105436254
3-Fluoro-4-(1-methylpiperidin-3-yl)butan-2-ol
CID 105443903

Frequently Asked Questions

What is the IUPAC name of 4-(diethylaminomethyl)cyclohexan-1-ol?
The IUPAC name of 4-(diethylaminomethyl)cyclohexan-1-ol (CID 90930897) is 4-(diethylaminomethyl)cyclohexan-1-ol.
What is the SMILES notation for 4-(diethylaminomethyl)cyclohexan-1-ol?
The canonical SMILES for 4-(diethylaminomethyl)cyclohexan-1-ol is CCN(CC)CC1CCC(O)CC1.
What is the InChIKey of 4-(diethylaminomethyl)cyclohexan-1-ol?
The InChIKey is ZHWWGKMUWDPKMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-12(4-2)9-10-5-7-11(13)8-6-10/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 4-(diethylaminomethyl)cyclohexan-1-ol?
4-(diethylaminomethyl)cyclohexan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylaminomethyl)cyclohexan-1-ol is sourced from PubChem (CID 90930897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).