N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide

C14H22N2O — CID 99646919

IUPACN-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide
SMILESCNC[C@@H](C)CNC(=O)Cc1cccc(C)c1
InChIInChI=1S/C14H22N2O/c1-11-5-4-6-13(7-11)8-14(17)16-10-12(2)9-15-3/h4-7,12,15H,8-10H2,1-3H3,(H,16,17)/t12-/m1/s1
InChIKeyYFCHXHGAGKJSAC-GFCCVEGCSA-N
MW234.34 g/mol
LogP1.51
Rot. Bonds6

About N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide

N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide (PubChem CID 99646919) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide
PubChem CID99646919
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide
SMILESCNC[C@@H](C)CNC(=O)Cc1cccc(C)c1
InChIInChI=1S/C14H22N2O/c1-11-5-4-6-13(7-11)8-14(17)16-10-12(2)9-15-3/h4-7,12,15H,8-10H2,1-3H3,(H,16,17)/t12-/m1/s1
InChIKeyYFCHXHGAGKJSAC-GFCCVEGCSA-N
XLogP1.51
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromopropyl)-2-(3-methylphenyl)acetamide
CID 114308603
methyl 2-hydroxy-3-[[2-(3-methylphenyl)acetyl]amino]propanoate
CID 103879292
N-(2-amino-3-hydroxybutyl)-2-(3-methylphenyl)acetamide
CID 64540830
2-(3,4-dichlorophenyl)-N-[2-methyl-3-(methylamino)propyl]acetamide
CID 81485987
4,4-dimethyl-2-[[[2-(3-methylphenyl)acetyl]amino]methyl]pentanoic acid
CID 107473898
N-(5-hydroxy-4-methylpentyl)-2-(3-methylphenyl)acetamide
CID 113340866
N-[(2S)-2-(dimethylamino)-2-phenylethyl]-2-(3-methylphenyl)acetamide
CID 41453338
2-(2,3-difluorophenyl)-N-[2-methyl-3-(methylamino)propyl]acetamide
CID 81486845
N-(5-chloro-4-methylpentyl)-2-(3-methylphenyl)acetamide
CID 114151356
N-(5-bromo-4-methylpentyl)-2-(3-methylphenyl)acetamide
CID 106157270
2-(2-bromophenyl)-N-[2-methyl-3-(methylamino)propyl]acetamide
CID 86813836
2-[4-[(3-methylphenyl)methylamino]phenyl]-N-(2-methylpropyl)acetamide
CID 46045368

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide?
The IUPAC name of N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide (CID 99646919) is N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide is CNC[C@@H](C)CNC(=O)Cc1cccc(C)c1.
What is the InChIKey of N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide?
The InChIKey is YFCHXHGAGKJSAC-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11-5-4-6-13(7-11)8-14(17)16-10-12(2)9-15-3/h4-7,12,15H,8-10H2,1-3H3,(H,16,17)/t12-/m1/s1.
What are the key properties of N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide?
N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide has a molecular weight of 234.34 g/mol, XLogP of 1.51, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-methyl-3-(methylamino)propyl]-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 99646919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).