N-(4-tert-butylphenyl)-3-phenoxypropanamide

C19H23NO2 — CID 7658805

IUPACN-(4-tert-butylphenyl)-3-phenoxypropanamide
SMILESCC(C)(C)c1ccc(NC(=O)CCOc2ccccc2)cc1
InChIInChI=1S/C19H23NO2/c1-19(2,3)15-9-11-16(12-10-15)20-18(21)13-14-22-17-7-5-4-6-8-17/h4-12H,13-14H2,1-3H3,(H,20,21)
InChIKeyYVTNRTDNHSNVLT-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.39
Rot. Bonds5

About N-(4-tert-butylphenyl)-3-phenoxypropanamide

N-(4-tert-butylphenyl)-3-phenoxypropanamide (PubChem CID 7658805) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-(4-tert-butylphenyl)-3-phenoxypropanamide.

Molecular Properties

Compound NameN-(4-tert-butylphenyl)-3-phenoxypropanamide
PubChem CID7658805
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-(4-tert-butylphenyl)-3-phenoxypropanamide
SMILESCC(C)(C)c1ccc(NC(=O)CCOc2ccccc2)cc1
InChIInChI=1S/C19H23NO2/c1-19(2,3)15-9-11-16(12-10-15)20-18(21)13-14-22-17-7-5-4-6-8-17/h4-12H,13-14H2,1-3H3,(H,20,21)
InChIKeyYVTNRTDNHSNVLT-UHFFFAOYSA-N
XLogP4.39
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-tert-butylphenoxy)-N-(4-methylphenyl)propanamide
CID 18266665
[2-(4-tert-butylanilino)-2-oxoethyl] 3-phenoxypropanoate
CID 7841562
3-phenoxy-N-(4-phenoxyphenyl)propanamide
CID 108795457
N-(4-butoxyphenyl)-4-(4-tert-butylphenoxy)butanamide
CID 19173570
2-(4-tert-butylphenoxy)-N-phenylacetamide
CID 963342
4-(3-anilino-3-oxopropoxy)benzoic acid
CID 43243922
3-(4-tert-butylphenoxy)-N-(3-chlorophenyl)propanamide
CID 2408222
3-(4-methylphenoxy)-N-(4-phenylphenyl)propanamide
CID 18276176
N-(5-tert-butyl-2-methoxyphenyl)-3-phenoxypropanamide
CID 4856932
3-(4-tert-butylphenoxy)-N-(6-methoxy-3-pyridinyl)propanamide
CID 18289170
N'-(4-tert-butylphenyl)-N-phenylpropanediamide
CID 108952831
N-[3,5-bis(trifluoromethyl)phenyl]-3-phenoxypropanamide
CID 108795497

Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylphenyl)-3-phenoxypropanamide?
The IUPAC name of N-(4-tert-butylphenyl)-3-phenoxypropanamide (CID 7658805) is N-(4-tert-butylphenyl)-3-phenoxypropanamide.
What is the SMILES notation for N-(4-tert-butylphenyl)-3-phenoxypropanamide?
The canonical SMILES for N-(4-tert-butylphenyl)-3-phenoxypropanamide is CC(C)(C)c1ccc(NC(=O)CCOc2ccccc2)cc1.
What is the InChIKey of N-(4-tert-butylphenyl)-3-phenoxypropanamide?
The InChIKey is YVTNRTDNHSNVLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-19(2,3)15-9-11-16(12-10-15)20-18(21)13-14-22-17-7-5-4-6-8-17/h4-12H,13-14H2,1-3H3,(H,20,21).
What are the key properties of N-(4-tert-butylphenyl)-3-phenoxypropanamide?
N-(4-tert-butylphenyl)-3-phenoxypropanamide has a molecular weight of 297.40 g/mol, XLogP of 4.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butylphenyl)-3-phenoxypropanamide is sourced from PubChem (CID 7658805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).