(2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide

C20H24N2O2 — CID 100568199

IUPAC(2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide
SMILESCNC(=O)[C@@H](C)N(Cc1ccccc1C)C(=O)Cc1ccccc1
InChIInChI=1S/C20H24N2O2/c1-15-9-7-8-12-18(15)14-22(16(2)20(24)21-3)19(23)13-17-10-5-4-6-11-17/h4-12,16H,13-14H2,1-3H3,(H,21,24)/t16-/m1/s1
InChIKeyJPAYRBVTRSVHFW-MRXNPFEDSA-N
MW324.42 g/mol
LogP2.70
Rot. Bonds6

About (2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide

(2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide (PubChem CID 100568199) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is (2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide.

Molecular Properties

Compound Name(2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide
PubChem CID100568199
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name(2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide
SMILESCNC(=O)[C@@H](C)N(Cc1ccccc1C)C(=O)Cc1ccccc1
InChIInChI=1S/C20H24N2O2/c1-15-9-7-8-12-18(15)14-22(16(2)20(24)21-3)19(23)13-17-10-5-4-6-11-17/h4-12,16H,13-14H2,1-3H3,(H,21,24)/t16-/m1/s1
InChIKeyJPAYRBVTRSVHFW-MRXNPFEDSA-N
XLogP2.70
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide
CID 100568207
N-[1-(methylamino)-1-oxopropan-2-yl]-N-[(2-methylphenyl)methyl]-3,3-diphenylpropanamide
CID 132664613
2-[[2-(2-fluorophenyl)acetyl]-[(2-methylphenyl)methyl]amino]-N-methylpropanamide
CID 132652351
2-[(2-chlorophenyl)methyl-[2-(2-methylphenyl)acetyl]amino]-N-methylpropanamide
CID 132654084
(2R)-2-[benzyl-[2-(3,5-dimethylphenyl)acetyl]amino]-N-methylpropanamide
CID 100568029
(2R)-2-[benzyl-[2-(4-chlorophenyl)acetyl]amino]-N-methylpropanamide
CID 100565411
2-[(4-bromophenyl)methyl-(2-phenylacetyl)amino]-N-methylpropanamide
CID 132763037
N-ethyl-2-[[2-(4-methylphenyl)acetyl]-[(2-methylphenyl)methyl]amino]propanamide
CID 132653228
(2R)-2-[[2-(4-chlorophenyl)acetyl]-[(2-methylphenyl)methyl]amino]-N-propan-2-ylpropanamide
CID 100652229
(2S)-2-[[2-(2-methylphenyl)acetyl]-[(2-methylphenyl)methyl]amino]-N-propan-2-ylpropanamide
CID 100655267
(2S)-2-[[2-(2-fluorophenyl)acetyl]-[(2-fluorophenyl)methyl]amino]-N-methylpropanamide
CID 100633860
(2S)-2-[benzyl-[2-(2-fluorophenyl)acetyl]amino]-N-methylpropanamide
CID 100568060

Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide?
The IUPAC name of (2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide (CID 100568199) is (2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide.
What is the SMILES notation for (2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide?
The canonical SMILES for (2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide is CNC(=O)[C@@H](C)N(Cc1ccccc1C)C(=O)Cc1ccccc1.
What is the InChIKey of (2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide?
The InChIKey is JPAYRBVTRSVHFW-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-15-9-7-8-12-18(15)14-22(16(2)20(24)21-3)19(23)13-17-10-5-4-6-11-17/h4-12,16H,13-14H2,1-3H3,(H,21,24)/t16-/m1/s1.
What are the key properties of (2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide?
(2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide has a molecular weight of 324.42 g/mol, XLogP of 2.70, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-2-[(2-methylphenyl)methyl-(2-phenylacetyl)amino]propanamide is sourced from PubChem (CID 100568199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).