2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide

C22H29NO2 — CID 54781980

IUPAC2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide
SMILESCC(C)Cc1ccc(C(C)C(=O)Nc2ccccc2OC(C)C)cc1
InChIInChI=1S/C22H29NO2/c1-15(2)14-18-10-12-19(13-11-18)17(5)22(24)23-20-8-6-7-9-21(20)25-16(3)4/h6-13,15-17H,14H2,1-5H3,(H,23,24)
InChIKeyCCGCUIALTQKRHY-UHFFFAOYSA-N
MW339.48 g/mol
LogP5.41
Rot. Bonds7

About 2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide

2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide (PubChem CID 54781980) has the molecular formula C22H29NO2 and a molecular weight of 339.48 g/mol. Its IUPAC name is 2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide.

Molecular Properties

Compound Name2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide
PubChem CID54781980
Molecular FormulaC22H29NO2
Molecular Weight339.48 g/mol
Exact Mass339.22
IUPAC Name2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide
SMILESCC(C)Cc1ccc(C(C)C(=O)Nc2ccccc2OC(C)C)cc1
InChIInChI=1S/C22H29NO2/c1-15(2)14-18-10-12-19(13-11-18)17(5)22(24)23-20-8-6-7-9-21(20)25-16(3)4/h6-13,15-17H,14H2,1-5H3,(H,23,24)
InChIKeyCCGCUIALTQKRHY-UHFFFAOYSA-N
XLogP5.41
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.48
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 14456233
(2S)-N-(2-ethylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 1228333
N-(2-methoxyphenyl)-4-[2-[4-(2-methylpropyl)phenyl]propanoylamino]butanamide
CID 127035008
N,2-bis[4-(2-methylpropyl)phenyl]propanamide
CID 3436173
N,N'-bis(2-propan-2-yloxyphenyl)oxamide
CID 108987298
N-[[2-(2-ethoxyethoxy)phenyl]carbamothioyl]-2-[4-(2-methylpropyl)phenyl]propanamide
CID 54782394
methyl 4,5-dimethoxy-2-[2-[4-(2-methylpropyl)phenyl]propanoylamino]benzoate
CID 2827389
N-(2,5-dimethylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 4681901
(2R)-N-(3,5-dimethoxyphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 102377979
(2R)-N-(2,4-dimethylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 1228302
(2R)-2-[4-(2-methylpropyl)phenyl]-N-(4-propan-2-ylphenyl)propanamide
CID 7313989
N-(2-methoxy-4-nitrophenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 54782184

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide?
The IUPAC name of 2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide (CID 54781980) is 2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide.
What is the SMILES notation for 2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide?
The canonical SMILES for 2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide is CC(C)Cc1ccc(C(C)C(=O)Nc2ccccc2OC(C)C)cc1.
What is the InChIKey of 2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide?
The InChIKey is CCGCUIALTQKRHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29NO2/c1-15(2)14-18-10-12-19(13-11-18)17(5)22(24)23-20-8-6-7-9-21(20)25-16(3)4/h6-13,15-17H,14H2,1-5H3,(H,23,24).
What are the key properties of 2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide?
2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide has a molecular weight of 339.48 g/mol, XLogP of 5.41, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methylpropyl)phenyl]-N-(2-propan-2-yloxyphenyl)propanamide is sourced from PubChem (CID 54781980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).