2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide

C13H20N2O — CID 60927229

IUPAC2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide
SMILESCNCC(=O)NC(C)Cc1ccccc1C
InChIInChI=1S/C13H20N2O/c1-10-6-4-5-7-12(10)8-11(2)15-13(16)9-14-3/h4-7,11,14H,8-9H2,1-3H3,(H,15,16)
InChIKeyCTKYCLDSEFLLLC-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.26
Rot. Bonds5

About 2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide

2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide (PubChem CID 60927229) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide
PubChem CID60927229
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide
SMILESCNCC(=O)NC(C)Cc1ccccc1C
InChIInChI=1S/C13H20N2O/c1-10-6-4-5-7-12(10)8-11(2)15-13(16)9-14-3/h4-7,11,14H,8-9H2,1-3H3,(H,15,16)
InChIKeyCTKYCLDSEFLLLC-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

N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 541803
2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 47062728
2-(cyclopropylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 54862344
N-methyl-2-[1-(2-methylphenyl)propan-2-ylamino]acetamide
CID 115706820
2-ethoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 61063462
2-bromo-3-methyl-N-[1-(2-methylphenyl)propan-2-yl]butanamide
CID 54867370
2-bromo-N-[1-(2-methylphenyl)propan-2-yl]butanamide
CID 62854671
3-(2-methoxyethoxy)-N-[(2R)-1-(2-methylphenyl)propan-2-yl]propanamide
CID 94799911
3-(ethylamino)-2-methyl-N-[1-(2-methylphenyl)propan-2-yl]propanamide
CID 62851503
(E)-4-[1-(2-methylphenyl)propan-2-ylamino]-4-oxobut-2-enoic acid
CID 54866883
(2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]butanamide;hydrochloride
CID 119297318
4-fluoro-N-[1-(2-methylphenyl)propan-2-yl]benzamide
CID 47296505

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide?
The IUPAC name of 2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide (CID 60927229) is 2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide.
What is the SMILES notation for 2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide?
The canonical SMILES for 2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide is CNCC(=O)NC(C)Cc1ccccc1C.
What is the InChIKey of 2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide?
The InChIKey is CTKYCLDSEFLLLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-6-4-5-7-12(10)8-11(2)15-13(16)9-14-3/h4-7,11,14H,8-9H2,1-3H3,(H,15,16).
What are the key properties of 2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide?
2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]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 2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide is sourced from PubChem (CID 60927229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).