2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide

C16H23NO3 — CID 7834380

IUPAC2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide
SMILESCOc1ccccc1OCC(=O)N[C@H]1CCCC[C@H]1C
InChIInChI=1S/C16H23NO3/c1-12-7-3-4-8-13(12)17-16(18)11-20-15-10-6-5-9-14(15)19-2/h5-6,9-10,12-13H,3-4,7-8,11H2,1-2H3,(H,17,18)/t12-,13+/m1/s1
InChIKeyXNBBFYOTCSNHLL-OLZOCXBDSA-N
MW277.36 g/mol
LogP2.77
Rot. Bonds5

About 2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide

2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide (PubChem CID 7834380) has the molecular formula C16H23NO3 and a molecular weight of 277.36 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide
PubChem CID7834380
Molecular FormulaC16H23NO3
Molecular Weight277.36 g/mol
Exact Mass277.17
IUPAC Name2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide
SMILESCOc1ccccc1OCC(=O)N[C@H]1CCCC[C@H]1C
InChIInChI=1S/C16H23NO3/c1-12-7-3-4-8-13(12)17-16(18)11-20-15-10-6-5-9-14(15)19-2/h5-6,9-10,12-13H,3-4,7-8,11H2,1-2H3,(H,17,18)/t12-,13+/m1/s1
InChIKeyXNBBFYOTCSNHLL-OLZOCXBDSA-N
XLogP2.77
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S,2R)-2-methylcyclohexyl]-2-naphthalen-1-yloxyacetamide
CID 2504510
N-[(1S,2R)-2-methylcyclohexyl]-2-(2-phenylphenoxy)acetamide
CID 7478838
2-[2-(methylaminomethyl)phenoxy]-N-(2-methylcyclohexyl)acetamide
CID 106484685
[2-[(2-methylcyclohexyl)amino]-2-oxoethyl] 2,6-dimethoxybenzoate
CID 5149215
2-(2,3-dichlorophenoxy)-N-[(1R,2S)-2-methylcyclohexyl]acetamide
CID 7787741
N-(2-bicyclo[2.2.1]heptanyl)-2-(2-methoxyphenoxy)acetamide
CID 3968254
N-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-2-(2-methoxyphenoxy)acetamide
CID 124923600
2-methoxy-N-[4-[2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethoxy]phenyl]benzamide
CID 9320007
[2-[[(1S,2R)-2-methylcyclohexyl]amino]-2-oxoethyl] 2-(2-chlorophenoxy)acetate
CID 2435738
[2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl] 2-(2-chlorophenoxy)acetate
CID 2435735
N-[(1S,2S)-2-methylcyclohexyl]-2-naphthalen-2-yloxyacetamide
CID 2517702
N-(2-methylcyclohexyl)-2-[(2-nitro-3-pyridinyl)oxy]acetamide
CID 4578815

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide (CID 7834380) is 2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide is COc1ccccc1OCC(=O)N[C@H]1CCCC[C@H]1C.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide?
The InChIKey is XNBBFYOTCSNHLL-OLZOCXBDSA-N. The full InChI is InChI=1S/C16H23NO3/c1-12-7-3-4-8-13(12)17-16(18)11-20-15-10-6-5-9-14(15)19-2/h5-6,9-10,12-13H,3-4,7-8,11H2,1-2H3,(H,17,18)/t12-,13+/m1/s1.
What are the key properties of 2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide?
2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide has a molecular weight of 277.36 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide is sourced from PubChem (CID 7834380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).