(3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide

C18H20N2O2 — CID 2664823

IUPAC(3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide
SMILESCC(=O)N[C@H](CC(=O)Nc1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C18H20N2O2/c1-13-8-10-16(11-9-13)20-18(22)12-17(19-14(2)21)15-6-4-3-5-7-15/h3-11,17H,12H2,1-2H3,(H,19,21)(H,20,22)/t17-/m1/s1
InChIKeyWOYAPQZYRYKLFH-QGZVFWFLSA-N
MW296.37 g/mol
LogP3.20
Rot. Bonds5

About (3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide

(3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide (PubChem CID 2664823) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is (3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide.

Molecular Properties

Compound Name(3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide
PubChem CID2664823
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name(3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide
SMILESCC(=O)N[C@H](CC(=O)Nc1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C18H20N2O2/c1-13-8-10-16(11-9-13)20-18(22)12-17(19-14(2)21)15-6-4-3-5-7-15/h3-11,17H,12H2,1-2H3,(H,19,21)(H,20,22)/t17-/m1/s1
InChIKeyWOYAPQZYRYKLFH-QGZVFWFLSA-N
XLogP3.20
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-acetamido-N-[4-(4-methylphenoxy)phenyl]-3-phenylpropanamide
CID 24636973
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
(3R)-3-acetamido-N-[4-(cyanomethyl)phenyl]-3-phenylpropanamide
CID 9259796
(3S)-3-acetamido-N-[4-(difluoromethoxy)phenyl]-3-phenylpropanamide
CID 8502651

Frequently Asked Questions

What is the IUPAC name of (3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide?
The IUPAC name of (3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide (CID 2664823) is (3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide.
What is the SMILES notation for (3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide?
The canonical SMILES for (3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide is CC(=O)N[C@H](CC(=O)Nc1ccc(C)cc1)c1ccccc1.
What is the InChIKey of (3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide?
The InChIKey is WOYAPQZYRYKLFH-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-13-8-10-16(11-9-13)20-18(22)12-17(19-14(2)21)15-6-4-3-5-7-15/h3-11,17H,12H2,1-2H3,(H,19,21)(H,20,22)/t17-/m1/s1.
What are the key properties of (3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide?
(3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide has a molecular weight of 296.37 g/mol, XLogP of 3.20, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide is sourced from PubChem (CID 2664823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).