2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide

C17H24FNO3 — CID 97237223

IUPAC2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide
SMILESC[C@H](NC(=O)COC1CCCCC1)[C@H](O)c1ccc(F)cc1
InChIInChI=1S/C17H24FNO3/c1-12(17(21)13-7-9-14(18)10-8-13)19-16(20)11-22-15-5-3-2-4-6-15/h7-10,12,15,17,21H,2-6,11H2,1H3,(H,19,20)/t12-,17-/m0/s1
InChIKeyGLKBMWAETGYMFF-SJCJKPOMSA-N
MW309.38 g/mol
LogP2.71
Rot. Bonds6

About 2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide

2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide (PubChem CID 97237223) has the molecular formula C17H24FNO3 and a molecular weight of 309.38 g/mol. Its IUPAC name is 2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide.

Molecular Properties

Compound Name2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide
PubChem CID97237223
Molecular FormulaC17H24FNO3
Molecular Weight309.38 g/mol
Exact Mass309.17
IUPAC Name2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide
SMILESC[C@H](NC(=O)COC1CCCCC1)[C@H](O)c1ccc(F)cc1
InChIInChI=1S/C17H24FNO3/c1-12(17(21)13-7-9-14(18)10-8-13)19-16(20)11-22-15-5-3-2-4-6-15/h7-10,12,15,17,21H,2-6,11H2,1H3,(H,19,20)/t12-,17-/m0/s1
InChIKeyGLKBMWAETGYMFF-SJCJKPOMSA-N
XLogP2.71
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.38
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-fluorophenyl)-1-hydroxypropan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 110000365
N-[1-(4-fluorophenyl)ethyl]-2-piperidin-4-yloxyacetamide
CID 63876747
N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]-2-phenoxyacetamide
CID 97069041
2-tert-butylsulfanyl-N-[(1S,2R)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide
CID 97237202
2-(3-methylcyclohexyl)oxy-N-[2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]acetamide
CID 86971033
N'-[1-(4-fluorophenyl)-1-hydroxypropan-2-yl]-N-(2,2,2-trifluoroethyl)propanediamide
CID 110017592
2-(cyclopentylamino)-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 60647303
2-[(2-cyclohexyloxyacetyl)amino]-2-phenylacetamide
CID 56814062
(2S)-2-[[(2-cyclohexyloxyacetyl)amino]methyl]-3-(4-fluorophenyl)propanamide
CID 95583426
2-(2-methylcyclohexyl)oxy-N-[2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]acetamide
CID 86971032
cyclohexyl 2-[(1-hydroxy-1-phenylpropan-2-yl)amino]acetate
CID 110183811
N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]-2-pyridin-4-ylsulfanylacetamide
CID 97237255

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide?
The IUPAC name of 2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide (CID 97237223) is 2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide.
What is the SMILES notation for 2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide?
The canonical SMILES for 2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide is C[C@H](NC(=O)COC1CCCCC1)[C@H](O)c1ccc(F)cc1.
What is the InChIKey of 2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide?
The InChIKey is GLKBMWAETGYMFF-SJCJKPOMSA-N. The full InChI is InChI=1S/C17H24FNO3/c1-12(17(21)13-7-9-14(18)10-8-13)19-16(20)11-22-15-5-3-2-4-6-15/h7-10,12,15,17,21H,2-6,11H2,1H3,(H,19,20)/t12-,17-/m0/s1.
What are the key properties of 2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide?
2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide has a molecular weight of 309.38 g/mol, XLogP of 2.71, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-N-[(1R,2S)-1-(4-fluorophenyl)-1-hydroxypropan-2-yl]acetamide is sourced from PubChem (CID 97237223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).