2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide

C20H29FN2O2 — CID 650020

IUPAC2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide
SMILESCC1CCCCC1NC(=O)CN1CCC(O)(c2ccc(F)cc2)CC1
InChIInChI=1S/C20H29FN2O2/c1-15-4-2-3-5-18(15)22-19(24)14-23-12-10-20(25,11-13-23)16-6-8-17(21)9-7-16/h6-9,15,18,25H,2-5,10-14H2,1H3,(H,22,24)
InChIKeyVOAAJCDJYIZNDF-UHFFFAOYSA-N
MW348.46 g/mol
LogP2.80
Rot. Bonds4

About 2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide

2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide (PubChem CID 650020) has the molecular formula C20H29FN2O2 and a molecular weight of 348.46 g/mol. Its IUPAC name is 2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide
PubChem CID650020
Molecular FormulaC20H29FN2O2
Molecular Weight348.46 g/mol
Exact Mass348.22
IUPAC Name2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide
SMILESCC1CCCCC1NC(=O)CN1CCC(O)(c2ccc(F)cc2)CC1
InChIInChI=1S/C20H29FN2O2/c1-15-4-2-3-5-18(15)22-19(24)14-23-12-10-20(25,11-13-23)16-6-8-17(21)9-7-16/h6-9,15,18,25H,2-5,10-14H2,1H3,(H,22,24)
InChIKeyVOAAJCDJYIZNDF-UHFFFAOYSA-N
XLogP2.80
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.46
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Piperidine-1-carboxamide, 21s
CID 44143402
Piperidine-1-carboxamide, 21g
CID 44143391
Piperidine-1-carboxamide, 21k
CID 44143395
N-[1-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-3-methyl-1-oxobutan-2-yl]benzamide
CID 57889234
[2-[4-[Hydroxy(diphenyl)methyl]piperidin-1-yl]-2-oxoethyl]urea
CID 2541146
5-[(4S,4aR,8aS)-4-hydroxy-4-phenyl-2,3,4a,5,6,7,8,8a-octahydroquinoline-1-carbonyl]pyrrolidin-2-one
CID 54586109
[(4S,4aR,8aS)-4-hydroxy-4-phenyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-1-yl]-(1-methylpiperidin-2-yl)methanone
CID 54587109
[(4S,4aR,8aS)-4-hydroxy-4-phenyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-1-yl]-piperazin-2-ylmethanone
CID 54587110
methyl N-[4-[(3R)-1-(2-aminoacetyl)piperidin-3-yl]-4-[2-(3-ethylphenyl)-3-fluorophenyl]-4-hydroxybutyl]carbamate
CID 145963814
N-Allyl-2-(4-hydroxy-4-phenyl-piperidin-1-yl)-acetamide
CID 650451
2-[3-(4-Fluorophenyl)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]-1-(3-methylpiperidin-1-yl)ethanone
CID 3228776
N-tert-Butyl-2-(4-hydroxy-4-phenyl-piperidin-1-yl)-acetamide
CID 649927

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide?
The IUPAC name of 2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide (CID 650020) is 2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide?
The canonical SMILES for 2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide is CC1CCCCC1NC(=O)CN1CCC(O)(c2ccc(F)cc2)CC1.
What is the InChIKey of 2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide?
The InChIKey is VOAAJCDJYIZNDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29FN2O2/c1-15-4-2-3-5-18(15)22-19(24)14-23-12-10-20(25,11-13-23)16-6-8-17(21)9-7-16/h6-9,15,18,25H,2-5,10-14H2,1H3,(H,22,24).
What are the key properties of 2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide?
2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide has a molecular weight of 348.46 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-N-(2-methylcyclohexyl)acetamide is sourced from PubChem (CID 650020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).