3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide

C24H24N2O3 — CID 24636973

IUPAC3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide
SMILESCC(=O)NC(CC(=O)Nc1ccc(Oc2ccc(C)cc2)cc1)c1ccccc1
InChIInChI=1S/C24H24N2O3/c1-17-8-12-21(13-9-17)29-22-14-10-20(11-15-22)26-24(28)16-23(25-18(2)27)19-6-4-3-5-7-19/h3-15,23H,16H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyLDOUARINCALILQ-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.99
Rot. Bonds7

About 3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide

3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide (PubChem CID 24636973) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide.

Molecular Properties

Compound Name3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide
PubChem CID24636973
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide
SMILESCC(=O)NC(CC(=O)Nc1ccc(Oc2ccc(C)cc2)cc1)c1ccccc1
InChIInChI=1S/C24H24N2O3/c1-17-8-12-21(13-9-17)29-22-14-10-20(11-15-22)26-24(28)16-23(25-18(2)27)19-6-4-3-5-7-19/h3-15,23H,16H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyLDOUARINCALILQ-UHFFFAOYSA-N
XLogP4.99
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide
CID 2664823
(3R)-3-acetamido-3-(4-methoxyphenyl)-N-(4-phenoxyphenyl)propanamide
CID 30685077
(3S)-3-acetamido-N-[4-(difluoromethoxy)phenyl]-3-phenylpropanamide
CID 8502651
N-[(1S)-3-(4-methylanilino)-3-oxo-1-phenylpropyl]benzamide
CID 7899822
3-acetamido-3-(4-chlorophenyl)-N-(4-methylphenyl)propanamide
CID 51194875
(3R)-3-acetamido-N-(3,4-dimethylphenyl)-3-phenylpropanamide
CID 8743897
(3S)-3-acetamido-N-(3-methylphenyl)-3-phenylpropanamide
CID 8713924
3-acetamido-3-(4-methylphenyl)-N-pyridin-4-ylpropanamide
CID 51314411
3-acetamido-N-(3,5-dimethylphenyl)-3-(4-methylphenyl)propanamide
CID 51195095
(3S)-3-acetamido-3-(4-methylphenyl)-N-[4-(trifluoromethyl)phenyl]propanamide
CID 26700777
(3R)-3-acetamido-N-(3-chloro-4-methylphenyl)-3-phenylpropanamide
CID 2665891
3-acetamido-N-(3,4-dichlorophenyl)-3-phenylpropanamide
CID 24638755

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide?
The IUPAC name of 3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide (CID 24636973) is 3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide.
What is the SMILES notation for 3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide?
The canonical SMILES for 3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide is CC(=O)NC(CC(=O)Nc1ccc(Oc2ccc(C)cc2)cc1)c1ccccc1.
What is the InChIKey of 3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide?
The InChIKey is LDOUARINCALILQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-17-8-12-21(13-9-17)29-22-14-10-20(11-15-22)26-24(28)16-23(25-18(2)27)19-6-4-3-5-7-19/h3-15,23H,16H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide?
3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide has a molecular weight of 388.47 g/mol, XLogP of 4.99, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide is sourced from PubChem (CID 24636973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).