2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone

C17H32N2O2 — CID 60694049

IUPAC2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone
SMILESCCC1CCCCN1C(=O)CN(CCO)C1CCCCC1
InChIInChI=1S/C17H32N2O2/c1-2-15-8-6-7-11-19(15)17(21)14-18(12-13-20)16-9-4-3-5-10-16/h15-16,20H,2-14H2,1H3
InChIKeyTWEIPYGFTXTYCZ-UHFFFAOYSA-N
MW296.45 g/mol
LogP2.40
Rot. Bonds6

About 2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone

2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone (PubChem CID 60694049) has the molecular formula C17H32N2O2 and a molecular weight of 296.45 g/mol. Its IUPAC name is 2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone
PubChem CID60694049
Molecular FormulaC17H32N2O2
Molecular Weight296.45 g/mol
Exact Mass296.25
IUPAC Name2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone
SMILESCCC1CCCCN1C(=O)CN(CCO)C1CCCCC1
InChIInChI=1S/C17H32N2O2/c1-2-15-8-6-7-11-19(15)17(21)14-18(12-13-20)16-9-4-3-5-10-16/h15-16,20H,2-14H2,1H3
InChIKeyTWEIPYGFTXTYCZ-UHFFFAOYSA-N
XLogP2.40
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.45
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(dipropylamino)-1-(2-ethylpiperidin-1-yl)ethanone
CID 86910548
N-cyclopentyl-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide
CID 113148905
1-(2-ethylpiperidin-1-yl)-2-[3-hydroxypropyl(propan-2-yl)amino]ethanone
CID 62021216
1-(2-ethylpiperidin-1-yl)-2-[N-(2-hydroxyethyl)anilino]ethanone
CID 110877170
1-[(2R)-2-ethylpiperidin-1-yl]propan-1-one
CID 40538705
2-[cyclopentyl(2-hydroxyethyl)amino]-1-(3,5-dimethylpiperidin-1-yl)ethanone
CID 62015648
2-chloro-1-[(2R)-2-ethylpiperidin-1-yl]ethanone
CID 7628883
1-(2-ethylpiperidin-1-yl)-2-[methyl-(2-methylcyclohexyl)amino]ethanone
CID 112815163
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-1-(2-ethylpiperidin-1-yl)ethanone;hydrochloride
CID 119928683
1-(2-ethylazepan-1-yl)ethanone
CID 115642380
1-(2-ethylazepan-1-yl)-3-methoxypropan-1-one
CID 167776443
4-(2-ethylazepan-1-yl)-4-oxobutanoic acid
CID 115910484

Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone?
The IUPAC name of 2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone (CID 60694049) is 2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone is CCC1CCCCN1C(=O)CN(CCO)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone?
The InChIKey is TWEIPYGFTXTYCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2/c1-2-15-8-6-7-11-19(15)17(21)14-18(12-13-20)16-9-4-3-5-10-16/h15-16,20H,2-14H2,1H3.
What are the key properties of 2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone?
2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone has a molecular weight of 296.45 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl(2-hydroxyethyl)amino]-1-(2-ethylpiperidin-1-yl)ethanone is sourced from PubChem (CID 60694049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).