4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol

C10H21NO — CID 20707711

IUPAC4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol
SMILESCCN(C)CC1CCC(O)CC1
InChIInChI=1S/C10H21NO/c1-3-11(2)8-9-4-6-10(12)7-5-9/h9-10,12H,3-8H2,1-2H3
InChIKeyDMXIGYXSWNZXSX-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.49
Rot. Bonds3

About 4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol

4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol (PubChem CID 20707711) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol
PubChem CID20707711
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol
SMILESCCN(C)CC1CCC(O)CC1
InChIInChI=1S/C10H21NO/c1-3-11(2)8-9-4-6-10(12)7-5-9/h9-10,12H,3-8H2,1-2H3
InChIKeyDMXIGYXSWNZXSX-UHFFFAOYSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.49
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-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol (CID 20707711) is 4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol is CCN(C)CC1CCC(O)CC1.
What is the InChIKey of 4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol?
The InChIKey is DMXIGYXSWNZXSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-3-11(2)8-9-4-6-10(12)7-5-9/h9-10,12H,3-8H2,1-2H3.
What are the key properties of 4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol?
4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol has a molecular weight of 171.28 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[ethyl(methyl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 20707711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).