N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide

C19H28N2O2 — CID 113052961

IUPACN-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide
SMILESCC(=O)N(CCNC(=O)Cc1ccccc1C)C1CCCCC1
InChIInChI=1S/C19H28N2O2/c1-15-8-6-7-9-17(15)14-19(23)20-12-13-21(16(2)22)18-10-4-3-5-11-18/h6-9,18H,3-5,10-14H2,1-2H3,(H,20,23)
InChIKeyIXKKXBLRGQKZSX-UHFFFAOYSA-N
MW316.44 g/mol
LogP2.83
Rot. Bonds6

About N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide

N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide (PubChem CID 113052961) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide
PubChem CID113052961
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC NameN-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide
SMILESCC(=O)N(CCNC(=O)Cc1ccccc1C)C1CCCCC1
InChIInChI=1S/C19H28N2O2/c1-15-8-6-7-9-17(15)14-19(23)20-12-13-21(16(2)22)18-10-4-3-5-11-18/h6-9,18H,3-5,10-14H2,1-2H3,(H,20,23)
InChIKeyIXKKXBLRGQKZSX-UHFFFAOYSA-N
XLogP2.83
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-bromophenyl)acetamide
CID 113052971
N-[2-[acetyl(cycloheptyl)amino]ethyl]-2-(4-fluorophenyl)acetamide
CID 113056716
N-[2-[acetyl(cycloheptyl)amino]ethyl]-2-(4-chlorophenyl)acetamide
CID 113056717
N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(4-methoxyphenyl)acetamide
CID 113052939
N-[2-[acetyl(cycloheptyl)amino]ethyl]-2-(4-methoxyphenyl)acetamide
CID 113056718
N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]-2-(2-fluorophenyl)acetamide
CID 113068164
2-[cyclohexyl(methyl)amino]-N-[(2-methylphenyl)methyl]acetamide
CID 51224648
N-[2-[acetyl(cyclohexyl)amino]ethyl]-4-methylbenzamide
CID 113052915
N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-bromobenzamide
CID 113052919
N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-(2-methylphenyl)acetamide
CID 113058904
N-[2-[acetyl(cyclopentyl)amino]ethyl]-2-methylpropanamide
CID 113052772
N-(2-bromoethyl)-N-cyclohexyl-2-(2-methylphenyl)acetamide
CID 80659112

Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide?
The IUPAC name of N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide (CID 113052961) is N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide.
What is the SMILES notation for N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide?
The canonical SMILES for N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide is CC(=O)N(CCNC(=O)Cc1ccccc1C)C1CCCCC1.
What is the InChIKey of N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide?
The InChIKey is IXKKXBLRGQKZSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-15-8-6-7-9-17(15)14-19(23)20-12-13-21(16(2)22)18-10-4-3-5-11-18/h6-9,18H,3-5,10-14H2,1-2H3,(H,20,23).
What are the key properties of N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide?
N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide has a molecular weight of 316.44 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide is sourced from PubChem (CID 113052961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).