[3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol

C16H32N2O — CID 79640098

IUPAC[3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol
SMILESCCNC1(CO)CCCC(N2CC(C)CCC2C)C1
InChIInChI=1S/C16H32N2O/c1-4-17-16(12-19)9-5-6-15(10-16)18-11-13(2)7-8-14(18)3/h13-15,17,19H,4-12H2,1-3H3
InChIKeyRQSLGGLPMZSAAD-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.39
Rot. Bonds4

About [3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol

[3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol (PubChem CID 79640098) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is [3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol
PubChem CID79640098
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name[3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol
SMILESCCNC1(CO)CCCC(N2CC(C)CCC2C)C1
InChIInChI=1S/C16H32N2O/c1-4-17-16(12-19)9-5-6-15(10-16)18-11-13(2)7-8-14(18)3/h13-15,17,19H,4-12H2,1-3H3
InChIKeyRQSLGGLPMZSAAD-UHFFFAOYSA-N
XLogP2.39
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexane-1-carboxylic acid
CID 79641319
[3-(2,5-dimethylpiperidin-1-yl)-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79656392
[1-(ethylamino)-3-(2-methylpiperidin-1-yl)cyclopentyl]methanol
CID 79656519
[1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol
CID 79633807
[1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol
CID 79641278
[1-(ethylamino)-3-(4-methoxypiperidin-1-yl)cyclohexyl]methanol
CID 79640451
[1-(ethylamino)-3-[3-(methoxymethyl)pyrrolidin-1-yl]cyclohexyl]methanol
CID 79640319
[3-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-1-(ethylamino)cyclohexyl]methanol
CID 79640787
[3-(2,6-dimethylmorpholin-4-yl)-1-(propylamino)cyclohexyl]methanol
CID 79634551
[1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol
CID 79634717
[1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclopentyl]methanol
CID 79656929
[1-(ethylamino)-3-(3-methylmorpholin-4-yl)cyclopentyl]methanol
CID 79655799

Frequently Asked Questions

What is the IUPAC name of [3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol?
The IUPAC name of [3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol (CID 79640098) is [3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol.
What is the SMILES notation for [3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol?
The canonical SMILES for [3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol is CCNC1(CO)CCCC(N2CC(C)CCC2C)C1.
What is the InChIKey of [3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol?
The InChIKey is RQSLGGLPMZSAAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-4-17-16(12-19)9-5-6-15(10-16)18-11-13(2)7-8-14(18)3/h13-15,17,19H,4-12H2,1-3H3.
What are the key properties of [3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol?
[3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol has a molecular weight of 268.44 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol is sourced from PubChem (CID 79640098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).