(2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone

C16H29NO3 — CID 56722289

IUPAC(2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone
SMILESCCOCC1CCN(C(=O)[C@H](O)C2CCCCC2)CC1
InChIInChI=1S/C16H29NO3/c1-2-20-12-13-8-10-17(11-9-13)16(19)15(18)14-6-4-3-5-7-14/h13-15,18H,2-12H2,1H3/t15-/m1/s1
InChIKeyJQDKQKVQJJTHKF-OAHLLOKOSA-N
MW283.41 g/mol
LogP2.20
Rot. Bonds5

About (2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone

(2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone (PubChem CID 56722289) has the molecular formula C16H29NO3 and a molecular weight of 283.41 g/mol. Its IUPAC name is (2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone.

Molecular Properties

Compound Name(2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone
PubChem CID56722289
Molecular FormulaC16H29NO3
Molecular Weight283.41 g/mol
Exact Mass283.21
IUPAC Name(2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone
SMILESCCOCC1CCN(C(=O)[C@H](O)C2CCCCC2)CC1
InChIInChI=1S/C16H29NO3/c1-2-20-12-13-8-10-17(11-9-13)16(19)15(18)14-6-4-3-5-7-14/h13-15,18H,2-12H2,1H3/t15-/m1/s1
InChIKeyJQDKQKVQJJTHKF-OAHLLOKOSA-N
XLogP2.20
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Hydroxy-1-[1-(2-methylpropanoyl)piperidin-4-YL]-1-azaspiro[3.5]nonan-2-one
CID 91912874
(4-Ethylcyclohexyl)-(3-hydroxy-4-methylpiperidin-1-yl)methanone
CID 121516217
2-cyclohexyl-2-hydroxy-N,N-dimethylacetamide
CID 316976
(2R,3S)-3-cyclohexyl-3-hydroxy-2-methyl-1-morpholin-4-ylpropan-1-one
CID 134965746
2-(4-Methoxycyclohexyl)-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)piperidin-1-yl]ethanone
CID 109871535
2-Hydroxy-1-piperidin-1-ylundecan-1-one
CID 14913073
1-(3-Hydroxypiperidin-1-yl)-3,7,11,15-tetramethylhexadecan-1-one
CID 21297912
N-(1-butanoylpiperidin-4-yl)-2-cyclohexyl-2-hydroxyacetamide
CID 25109035
(3R)-3-amino-4-cyclohexyl-1-(2,6-dimethylmorpholin-4-yl)-2-hydroxybutan-1-one
CID 54004154
(2S)-2-cyclohexyl-2-hydroxy-N,N-dimethylacetamide
CID 58015661
(2S)-3-cyclohexyl-2-hydroxy-1-piperidin-1-ylpropan-1-one
CID 59948409
(S)-3-cyclohexyl-2-hydroxy-1-morpholin-4-yl-propan-1-one
CID 59949122

Frequently Asked Questions

What is the IUPAC name of (2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone?
The IUPAC name of (2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone (CID 56722289) is (2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone.
What is the SMILES notation for (2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone?
The canonical SMILES for (2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone is CCOCC1CCN(C(=O)[C@H](O)C2CCCCC2)CC1.
What is the InChIKey of (2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone?
The InChIKey is JQDKQKVQJJTHKF-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H29NO3/c1-2-20-12-13-8-10-17(11-9-13)16(19)15(18)14-6-4-3-5-7-14/h13-15,18H,2-12H2,1H3/t15-/m1/s1.
What are the key properties of (2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone?
(2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone has a molecular weight of 283.41 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-cyclohexyl-1-[4-(ethoxymethyl)piperidin-1-yl]-2-hydroxyethanone is sourced from PubChem (CID 56722289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).