2-(2-butan-2-ylphenoxy)-N-phenylpropanamide

C19H23NO2 — CID 17129825

IUPAC2-(2-butan-2-ylphenoxy)-N-phenylpropanamide
SMILESCCC(C)c1ccccc1OC(C)C(=O)Nc1ccccc1
InChIInChI=1S/C19H23NO2/c1-4-14(2)17-12-8-9-13-18(17)22-15(3)19(21)20-16-10-6-5-7-11-16/h5-15H,4H2,1-3H3,(H,20,21)
InChIKeyQPTQMEWVOZRDEF-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.61
Rot. Bonds6

About 2-(2-butan-2-ylphenoxy)-N-phenylpropanamide

2-(2-butan-2-ylphenoxy)-N-phenylpropanamide (PubChem CID 17129825) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-(2-butan-2-ylphenoxy)-N-phenylpropanamide.

Molecular Properties

Compound Name2-(2-butan-2-ylphenoxy)-N-phenylpropanamide
PubChem CID17129825
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name2-(2-butan-2-ylphenoxy)-N-phenylpropanamide
SMILESCCC(C)c1ccccc1OC(C)C(=O)Nc1ccccc1
InChIInChI=1S/C19H23NO2/c1-4-14(2)17-12-8-9-13-18(17)22-15(3)19(21)20-16-10-6-5-7-11-16/h5-15H,4H2,1-3H3,(H,20,21)
InChIKeyQPTQMEWVOZRDEF-UHFFFAOYSA-N
XLogP4.61
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-[2-(2-butan-2-ylphenoxy)propanoylamino]phenyl]-2,2-dimethylpropanamide
CID 17204655
2-(2-butan-2-ylphenoxy)-N-(3,4-dimethoxyphenyl)propanamide
CID 54781417
N-[4-[2-(2-butan-2-ylphenoxy)propanoylamino]phenyl]-4-tert-butylbenzamide
CID 17235107
N-[4-(benzylsulfamoyl)phenyl]-2-(2-butan-2-ylphenoxy)propanamide
CID 17129907
N-benzyl-2-(2-butan-2-ylphenoxy)propanamide
CID 17129862
2-(2-butan-2-ylphenoxy)-N-(2,4,5-trichlorophenyl)propanamide
CID 17129881
4-[2-(2-butan-2-ylphenoxy)butanoylamino]benzoic acid
CID 54855905
2-(2-butan-2-ylphenoxy)-N-[3-[3-(dimethylamino)-3-oxopropyl]phenyl]propanamide
CID 43912158
2-(2-butan-2-ylphenoxy)-N'-(2-phenylacetyl)propanehydrazide
CID 17129998
N-(4-aminophenyl)-2-(2-butan-2-ylphenoxy)butanamide
CID 46735880
(2S)-N-(4-ethylphenyl)-2-(2-propan-2-ylphenoxy)propanamide
CID 38017067
2-(2-butan-2-ylphenoxy)-N-[2-methyl-3-(propanoylamino)phenyl]propanamide
CID 46760646

Frequently Asked Questions

What is the IUPAC name of 2-(2-butan-2-ylphenoxy)-N-phenylpropanamide?
The IUPAC name of 2-(2-butan-2-ylphenoxy)-N-phenylpropanamide (CID 17129825) is 2-(2-butan-2-ylphenoxy)-N-phenylpropanamide.
What is the SMILES notation for 2-(2-butan-2-ylphenoxy)-N-phenylpropanamide?
The canonical SMILES for 2-(2-butan-2-ylphenoxy)-N-phenylpropanamide is CCC(C)c1ccccc1OC(C)C(=O)Nc1ccccc1.
What is the InChIKey of 2-(2-butan-2-ylphenoxy)-N-phenylpropanamide?
The InChIKey is QPTQMEWVOZRDEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-4-14(2)17-12-8-9-13-18(17)22-15(3)19(21)20-16-10-6-5-7-11-16/h5-15H,4H2,1-3H3,(H,20,21).
What are the key properties of 2-(2-butan-2-ylphenoxy)-N-phenylpropanamide?
2-(2-butan-2-ylphenoxy)-N-phenylpropanamide has a molecular weight of 297.40 g/mol, XLogP of 4.61, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-butan-2-ylphenoxy)-N-phenylpropanamide is sourced from PubChem (CID 17129825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).