(3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide

C18H20N2O2 — CID 2599103

IUPAC(3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide
SMILESCC(=O)N[C@H](CC(=O)Nc1ccccc1C)c1ccccc1
InChIInChI=1S/C18H20N2O2/c1-13-8-6-7-11-16(13)20-18(22)12-17(19-14(2)21)15-9-4-3-5-10-15/h3-11,17H,12H2,1-2H3,(H,19,21)(H,20,22)/t17-/m1/s1
InChIKeyIOGGTMSTZIUDBK-QGZVFWFLSA-N
MW296.37 g/mol
LogP3.20
Rot. Bonds5

About (3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide

(3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide (PubChem CID 2599103) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is (3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide.

Molecular Properties

Compound Name(3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide
PubChem CID2599103
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name(3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide
SMILESCC(=O)N[C@H](CC(=O)Nc1ccccc1C)c1ccccc1
InChIInChI=1S/C18H20N2O2/c1-13-8-6-7-11-16(13)20-18(22)12-17(19-14(2)21)15-9-4-3-5-10-15/h3-11,17H,12H2,1-2H3,(H,19,21)(H,20,22)/t17-/m1/s1
InChIKeyIOGGTMSTZIUDBK-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-(2-hydroxyphenyl)-3-phenylpropanamide
CID 78796655
N-[(1R)-3-(2-methylanilino)-3-oxo-1-phenylpropyl]benzamide
CID 7946567
3-acetamido-N-(4-fluoro-2-methylphenyl)-3-phenylpropanamide
CID 4792587
(3S)-3-acetamido-N-(2-benzylphenyl)-3-phenylpropanamide
CID 2555292
3-acetamido-N-(3-chloro-2-methylphenyl)-3-phenylpropanamide
CID 17401242
(3S)-3-acetamido-N-(2-methoxyphenyl)-3-phenylpropanamide
CID 41075346
3-acetamido-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]-3-phenylpropanamide
CID 55762719
methyl 3-[[(3R)-3-acetamido-3-phenylpropanoyl]amino]-4-methylbenzoate
CID 8920175
(3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide
CID 2664823
(3R)-3-acetamido-N-(3,4-dimethylphenyl)-3-phenylpropanamide
CID 8743897
(3R)-N-(2-methylphenyl)-3-phenylbutanamide
CID 7946569
3-acetamido-N-(2-bromophenyl)-3-(4-methylphenyl)propanamide
CID 51194779

Frequently Asked Questions

What is the IUPAC name of (3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide?
The IUPAC name of (3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide (CID 2599103) is (3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide.
What is the SMILES notation for (3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide?
The canonical SMILES for (3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide is CC(=O)N[C@H](CC(=O)Nc1ccccc1C)c1ccccc1.
What is the InChIKey of (3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide?
The InChIKey is IOGGTMSTZIUDBK-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-13-8-6-7-11-16(13)20-18(22)12-17(19-14(2)21)15-9-4-3-5-10-15/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-(2-methylphenyl)-3-phenylpropanamide?
(3R)-3-acetamido-N-(2-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-(2-methylphenyl)-3-phenylpropanamide is sourced from PubChem (CID 2599103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).