2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide

C18H27NO2 — CID 130242276

IUPAC2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide
SMILESCOC1CCC(C)(NC(=O)Cc2cc(C)ccc2C)CC1
InChIInChI=1S/C18H27NO2/c1-13-5-6-14(2)15(11-13)12-17(20)19-18(3)9-7-16(21-4)8-10-18/h5-6,11,16H,7-10,12H2,1-4H3,(H,19,20)
InChIKeySYNQWUOPOMUJOX-UHFFFAOYSA-N
MW289.42 g/mol
LogP3.31
Rot. Bonds4

About 2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide

2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide (PubChem CID 130242276) has the molecular formula C18H27NO2 and a molecular weight of 289.42 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide
PubChem CID130242276
Molecular FormulaC18H27NO2
Molecular Weight289.42 g/mol
Exact Mass289.20
IUPAC Name2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide
SMILESCOC1CCC(C)(NC(=O)Cc2cc(C)ccc2C)CC1
InChIInChI=1S/C18H27NO2/c1-13-5-6-14(2)15(11-13)12-17(20)19-18(3)9-7-16(21-4)8-10-18/h5-6,11,16H,7-10,12H2,1-4H3,(H,19,20)
InChIKeySYNQWUOPOMUJOX-UHFFFAOYSA-N
XLogP3.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-methoxy-1-methylcyclohexyl)-2-(2-methylphenyl)acetamide
CID 59483304
N-[1-(chloromethyl)-4-methylcyclohexyl]-2-(2,5-dimethylphenyl)acetamide
CID 114304371
N-[1-(chloromethyl)-3-methylcyclohexyl]-2-(2,5-dimethylphenyl)acetamide
CID 114304114
N-(1-adamantyl)-2-(2,5-dimethylphenyl)acetamide
CID 92682215
methyl 4-[[2-(2,5-dimethylphenyl)acetyl]amino]-1-ethoxypiperidine-4-carboxylate
CID 59614582
1-(2,5-dimethylphenyl)-4-methoxycyclohexan-1-ol
CID 113414594
2-(2,5-dimethylphenyl)-N-piperidin-4-ylacetamide
CID 62537679
N-(4-cyanooxan-4-yl)-2-(2,5-dimethylphenyl)acetamide
CID 18710449
N-[[2-(chloromethyl)cyclohexyl]methyl]-2-(2,5-dimethylphenyl)acetamide
CID 114307113
trans-(1R,2R)-2-[[2-(2,5-dimethylphenyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 95363924
(2S)-2-[[2-(2,5-dimethylphenyl)acetyl]amino]propanoic acid
CID 62538173
N-[(2,5-dimethylphenyl)methyl]-3,3-dimethylcyclopentan-1-amine
CID 114544212

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide?
The IUPAC name of 2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide (CID 130242276) is 2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide?
The canonical SMILES for 2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide is COC1CCC(C)(NC(=O)Cc2cc(C)ccc2C)CC1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide?
The InChIKey is SYNQWUOPOMUJOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO2/c1-13-5-6-14(2)15(11-13)12-17(20)19-18(3)9-7-16(21-4)8-10-18/h5-6,11,16H,7-10,12H2,1-4H3,(H,19,20).
What are the key properties of 2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide?
2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide has a molecular weight of 289.42 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-N-(4-methoxy-1-methylcyclohexyl)acetamide is sourced from PubChem (CID 130242276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).