N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide

C13H20N2O — CID 115706820

IUPACN-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide
SMILESCNC(=O)CNC(C)Cc1ccccc1C
InChIInChI=1S/C13H20N2O/c1-10-6-4-5-7-12(10)8-11(2)15-9-13(16)14-3/h4-7,11,15H,8-9H2,1-3H3,(H,14,16)
InChIKeyJYKNTPNGXXRXHT-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.26
Rot. Bonds5

About N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide

N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide (PubChem CID 115706820) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide
PubChem CID115706820
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide
SMILESCNC(=O)CNC(C)Cc1ccccc1C
InChIInChI=1S/C13H20N2O/c1-10-6-4-5-7-12(10)8-11(2)15-9-13(16)14-3/h4-7,11,15H,8-9H2,1-3H3,(H,14,16)
InChIKeyJYKNTPNGXXRXHT-UHFFFAOYSA-N
XLogP1.26
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 60927229
N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 541803
N-ethyl-1-(2-methylphenyl)propan-2-amine
CID 14025646
2-[1-(3-fluorophenyl)propan-2-ylamino]-N-methylacetamide
CID 115706785
2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 47062728
2-(cyclopropylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 54862344
4-methyl-2-[[1-(2-methylphenyl)propan-2-ylamino]methyl]pentanoic acid
CID 122127944
2,2-dimethyl-N-[1-(2-methylphenyl)propan-2-yl]propan-1-amine
CID 61325570
ethane;(3S)-3-[(2-methylphenyl)methylamino]butan-2-one
CID 90780067
2-bromo-3-methyl-N-[1-(2-methylphenyl)propan-2-yl]butanamide
CID 54867370
(2S)-1-(2-methylphenyl)-N-[(2S)-2-[(S)-methylsulfinyl]propyl]propan-2-amine
CID 97108128
2-bromo-N-[1-(2-methylphenyl)propan-2-yl]butanamide
CID 62854671

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide?
The IUPAC name of N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide (CID 115706820) is N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide.
What is the SMILES notation for N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide?
The canonical SMILES for N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide is CNC(=O)CNC(C)Cc1ccccc1C.
What is the InChIKey of N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide?
The InChIKey is JYKNTPNGXXRXHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-6-4-5-7-12(10)8-11(2)15-9-13(16)14-3/h4-7,11,15H,8-9H2,1-3H3,(H,14,16).
What are the key properties of N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide?
N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide has a molecular weight of 220.32 g/mol, XLogP of 1.26, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide is sourced from PubChem (CID 115706820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).