2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide

C17H25NO3 — CID 111120177

IUPAC2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide
SMILESCc1ccccc1C(O)CNC(=O)COC1CCCCC1
InChIInChI=1S/C17H25NO3/c1-13-7-5-6-10-15(13)16(19)11-18-17(20)12-21-14-8-3-2-4-9-14/h5-7,10,14,16,19H,2-4,8-9,11-12H2,1H3,(H,18,20)
InChIKeyQHLXSAVQBOHKIX-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.49
Rot. Bonds6

About 2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide

2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide (PubChem CID 111120177) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is 2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide
PubChem CID111120177
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC Name2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide
SMILESCc1ccccc1C(O)CNC(=O)COC1CCCCC1
InChIInChI=1S/C17H25NO3/c1-13-7-5-6-10-15(13)16(19)11-18-17(20)12-21-14-8-3-2-4-9-14/h5-7,10,14,16,19H,2-4,8-9,11-12H2,1H3,(H,18,20)
InChIKeyQHLXSAVQBOHKIX-UHFFFAOYSA-N
XLogP2.49
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-3-oxopropyl]cyclohexanecarboxamide
CID 111120078
N-[2-(2-chlorophenyl)-2-hydroxyethyl]-2-(3-methylcyclohexyl)oxyacetamide
CID 111450960
N-[2-hydroxy-2-(2-methylphenyl)ethyl]-4-methylpentanamide
CID 111119754
2-cyclopentyloxy-N-[(2R)-2-phenoxypropyl]acetamide
CID 95901206
2-cyclopentyloxy-N-[(2S)-2-phenoxypropyl]acetamide
CID 95901205
N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(methylamino)acetamide
CID 119784439
1-[2-hydroxy-2-(2-methylphenyl)ethyl]-3-(2-methylpropyl)urea
CID 111119518
N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(3-methylphenoxy)acetamide
CID 111119904
benzyl N-[(2S)-2-hydroxy-2-(2-methylphenyl)ethyl]carbamate
CID 124679296
1-cyclopentyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]pyrrole-2-carboxamide
CID 110007652
N-[2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-2-oxoethyl]benzamide
CID 111120128
1-[2-hydroxy-2-(2-methylphenyl)ethyl]-3-(2-methylcyclopropyl)urea
CID 111119604

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide?
The IUPAC name of 2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide (CID 111120177) is 2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide?
The canonical SMILES for 2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide is Cc1ccccc1C(O)CNC(=O)COC1CCCCC1.
What is the InChIKey of 2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide?
The InChIKey is QHLXSAVQBOHKIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO3/c1-13-7-5-6-10-15(13)16(19)11-18-17(20)12-21-14-8-3-2-4-9-14/h5-7,10,14,16,19H,2-4,8-9,11-12H2,1H3,(H,18,20).
What are the key properties of 2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide?
2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide has a molecular weight of 291.39 g/mol, XLogP of 2.49, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide is sourced from PubChem (CID 111120177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).