2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide

C22H34N2O2 — CID 113159574

IUPAC2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
SMILESCC(=O)N(CC(=O)Nc1c(C(C)C)cccc1C(C)C)C1CCCCC1
InChIInChI=1S/C22H34N2O2/c1-15(2)19-12-9-13-20(16(3)4)22(19)23-21(26)14-24(17(5)25)18-10-7-6-8-11-18/h9,12-13,15-16,18H,6-8,10-11,14H2,1-5H3,(H,23,26)
InChIKeyCLGMOHGOODXIGH-UHFFFAOYSA-N
MW358.53 g/mol
LogP5.05
Rot. Bonds6

About 2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide

2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide (PubChem CID 113159574) has the molecular formula C22H34N2O2 and a molecular weight of 358.53 g/mol. Its IUPAC name is 2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
PubChem CID113159574
Molecular FormulaC22H34N2O2
Molecular Weight358.53 g/mol
Exact Mass358.26
IUPAC Name2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
SMILESCC(=O)N(CC(=O)Nc1c(C(C)C)cccc1C(C)C)C1CCCCC1
InChIInChI=1S/C22H34N2O2/c1-15(2)19-12-9-13-20(16(3)4)22(19)23-21(26)14-24(17(5)25)18-10-7-6-8-11-18/h9,12-13,15-16,18H,6-8,10-11,14H2,1-5H3,(H,23,26)
InChIKeyCLGMOHGOODXIGH-UHFFFAOYSA-N
XLogP5.05
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.53
LogP ≤ 55.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[acetyl(cyclohexyl)amino]-N-(2-propan-2-ylphenyl)acetamide
CID 113159511
2-[acetyl(cyclohexyl)amino]-N-(2-ethyl-6-methylphenyl)acetamide
CID 113159510
2-[acetyl(propan-2-yl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 113158268
N-[2,6-di(propan-2-yl)phenyl]cyclohexanecarboxamide
CID 729635
2-[4-[cyclohexyl(methyl)sulfamoyl]piperazin-1-yl]-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 46405623
bis(2-[carboxymethyl-[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl]amino]acetic acid);chromium(3+)
CID 159006610
2-[acetyl(cyclohexyl)amino]-N-(3-bromophenyl)acetamide
CID 113159568
2-[acetyl(cyclohexyl)amino]-N-(2-propan-2-yloxyphenyl)acetamide
CID 113159539
3-[cyclohexyl(methylsulfonyl)amino]-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 113137458
2-[acetyl(cycloheptyl)amino]-N-(4-acetylphenyl)acetamide
CID 113166396
2-[acetyl(prop-2-enyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 84563712
[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl] 2-cyclohexylacetate
CID 42968314

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide?
The IUPAC name of 2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide (CID 113159574) is 2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide.
What is the SMILES notation for 2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide?
The canonical SMILES for 2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide is CC(=O)N(CC(=O)Nc1c(C(C)C)cccc1C(C)C)C1CCCCC1.
What is the InChIKey of 2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide?
The InChIKey is CLGMOHGOODXIGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N2O2/c1-15(2)19-12-9-13-20(16(3)4)22(19)23-21(26)14-24(17(5)25)18-10-7-6-8-11-18/h9,12-13,15-16,18H,6-8,10-11,14H2,1-5H3,(H,23,26).
What are the key properties of 2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide?
2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide has a molecular weight of 358.53 g/mol, XLogP of 5.05, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(cyclohexyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide is sourced from PubChem (CID 113159574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).