2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide

C15H20FNO3 — CID 106121345

IUPAC2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide
SMILESO=C(COc1cccc(F)c1)NCC1CCC(O)CC1
InChIInChI=1S/C15H20FNO3/c16-12-2-1-3-14(8-12)20-10-15(19)17-9-11-4-6-13(18)7-5-11/h1-3,8,11,13,18H,4-7,9-10H2,(H,17,19)
InChIKeyCWXHRLIIZUORRW-UHFFFAOYSA-N
MW281.33 g/mol
LogP1.87
Rot. Bonds5

About 2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide

2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide (PubChem CID 106121345) has the molecular formula C15H20FNO3 and a molecular weight of 281.33 g/mol. Its IUPAC name is 2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide
PubChem CID106121345
Molecular FormulaC15H20FNO3
Molecular Weight281.33 g/mol
Exact Mass281.14
IUPAC Name2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide
SMILESO=C(COc1cccc(F)c1)NCC1CCC(O)CC1
InChIInChI=1S/C15H20FNO3/c16-12-2-1-3-14(8-12)20-10-15(19)17-9-11-4-6-13(18)7-5-11/h1-3,8,11,13,18H,4-7,9-10H2,(H,17,19)
InChIKeyCWXHRLIIZUORRW-UHFFFAOYSA-N
XLogP1.87
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-fluorophenoxy)-N-[(3-hydroxycyclopentyl)methyl]acetamide
CID 103280490
2-(4-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide
CID 106122071
[2-(cyclohexylmethylamino)-2-oxoethyl] 2-(3-fluorophenoxy)acetate
CID 2382552
N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide
CID 55572986
2-[3-(2-aminoethyl)phenoxy]-N-(cyclopropylmethyl)acetamide
CID 54930853
N-(2-bromoprop-2-enyl)-2-(3-fluorophenoxy)acetamide
CID 115594649
[2-oxo-2-[[(2R)-oxolan-2-yl]methylamino]ethyl] 2-(3-fluorophenoxy)acetate
CID 2369928
2-(3-fluorophenoxy)-N-[(1-pent-2-ynylpiperidin-3-yl)methyl]acetamide
CID 131915595
2-(3-fluorophenoxy)-N-prop-2-ynylacetamide
CID 9008020
2-(2,3-dimethylphenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide
CID 106124065
N-(cyclopropylmethyl)-2-[1-[(3-fluorophenyl)methyl]-4-methyl-2-oxoquinolin-7-yl]oxyacetamide
CID 42877905
N-(cyclopropylmethyl)-2-[(3-fluorophenyl)methylsulfinyl]acetamide
CID 56827603

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide?
The IUPAC name of 2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide (CID 106121345) is 2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide.
What is the SMILES notation for 2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide?
The canonical SMILES for 2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide is O=C(COc1cccc(F)c1)NCC1CCC(O)CC1.
What is the InChIKey of 2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide?
The InChIKey is CWXHRLIIZUORRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO3/c16-12-2-1-3-14(8-12)20-10-15(19)17-9-11-4-6-13(18)7-5-11/h1-3,8,11,13,18H,4-7,9-10H2,(H,17,19).
What are the key properties of 2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide?
2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide has a molecular weight of 281.33 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide is sourced from PubChem (CID 106121345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).