N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide

C16H22FNO3 — CID 90498777

IUPACN-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide
SMILESO=C(COc1ccccc1F)NCC(O)C1CCCCC1
InChIInChI=1S/C16H22FNO3/c17-13-8-4-5-9-15(13)21-11-16(20)18-10-14(19)12-6-2-1-3-7-12/h4-5,8-9,12,14,19H,1-3,6-7,10-11H2,(H,18,20)
InChIKeyBJQIXJUWOPVSKK-UHFFFAOYSA-N
MW295.35 g/mol
LogP2.26
Rot. Bonds6

About N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide

N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide (PubChem CID 90498777) has the molecular formula C16H22FNO3 and a molecular weight of 295.35 g/mol. Its IUPAC name is N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide
PubChem CID90498777
Molecular FormulaC16H22FNO3
Molecular Weight295.35 g/mol
Exact Mass295.16
IUPAC NameN-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide
SMILESO=C(COc1ccccc1F)NCC(O)C1CCCCC1
InChIInChI=1S/C16H22FNO3/c17-13-8-4-5-9-15(13)21-11-16(20)18-10-14(19)12-6-2-1-3-7-12/h4-5,8-9,12,14,19H,1-3,6-7,10-11H2,(H,18,20)
InChIKeyBJQIXJUWOPVSKK-UHFFFAOYSA-N
XLogP2.26
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclopropyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide
CID 63299007
N-(2-cyclopentyl-2-hydroxyethyl)-4-(2-fluorophenoxy)butanamide
CID 111426079
N-(2-cyclohexyl-2-hydroxyethyl)-2-(4-fluorophenoxy)acetamide
CID 90498778
N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-3-(2-fluorophenyl)propanamide
CID 95292204
N-(2-cyclopropyl-2-hydroxyethyl)-2-phenoxyacetamide
CID 63294026
N-(2-cyclohexyl-2-hydroxyethyl)-2-(4-methylphenoxy)acetamide
CID 90498772
N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(3-methoxyphenoxy)acetamide
CID 95983036
N-[2-(4-chlorophenyl)-2-hydroxyethyl]-2-(2-fluorophenoxy)acetamide
CID 110663511
2-(2-fluorophenoxy)-N-(2-hydroxycyclohexyl)acetamide
CID 62360872
N-(2-cyclohexyl-2-hydroxyethyl)-2-(4-fluorophenyl)sulfanylacetamide
CID 71782115
2-(2-fluorophenoxy)-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)acetamide
CID 16931345
N-[(2R)-2-(dimethylamino)-2-phenylethyl]-2-(2-fluorophenoxy)acetamide
CID 41318277

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide?
The IUPAC name of N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide (CID 90498777) is N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide.
What is the SMILES notation for N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide?
The canonical SMILES for N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide is O=C(COc1ccccc1F)NCC(O)C1CCCCC1.
What is the InChIKey of N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide?
The InChIKey is BJQIXJUWOPVSKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO3/c17-13-8-4-5-9-15(13)21-11-16(20)18-10-14(19)12-6-2-1-3-7-12/h4-5,8-9,12,14,19H,1-3,6-7,10-11H2,(H,18,20).
What are the key properties of N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide?
N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide has a molecular weight of 295.35 g/mol, XLogP of 2.26, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyl-2-hydroxyethyl)-2-(2-fluorophenoxy)acetamide is sourced from PubChem (CID 90498777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).