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

C13H19NO2 — CID 47062728

IUPAC2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide
SMILESCOCC(=O)NC(C)Cc1ccccc1C
InChIInChI=1S/C13H19NO2/c1-10-6-4-5-7-12(10)8-11(2)14-13(15)9-16-3/h4-7,11H,8-9H2,1-3H3,(H,14,15)
InChIKeyYFQXFCBDLROEAZ-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.69
Rot. Bonds5

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

2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide (PubChem CID 47062728) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide
PubChem CID47062728
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide
SMILESCOCC(=O)NC(C)Cc1ccccc1C
InChIInChI=1S/C13H19NO2/c1-10-6-4-5-7-12(10)8-11(2)14-13(15)9-16-3/h4-7,11H,8-9H2,1-3H3,(H,14,15)
InChIKeyYFQXFCBDLROEAZ-UHFFFAOYSA-N
XLogP1.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 61063462
3-(2-methoxyethoxy)-N-[(2R)-1-(2-methylphenyl)propan-2-yl]propanamide
CID 94799911
2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 60927229
N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 541803
2-(cyclopropylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 54862344
N-[(2R)-1-(1H-indol-3-yl)propan-2-yl]-2-methoxyacetamide
CID 53348431
(E)-4-[1-(2-methylphenyl)propan-2-ylamino]-4-oxobut-2-enoic acid
CID 54866883
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
N-[1-(3,5-dimethylphenyl)propan-2-yl]-2-methoxyacetamide
CID 71998958
(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-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide?
The IUPAC name of 2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide (CID 47062728) is 2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide.
What is the SMILES notation for 2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide?
The canonical SMILES for 2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide is COCC(=O)NC(C)Cc1ccccc1C.
What is the InChIKey of 2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide?
The InChIKey is YFQXFCBDLROEAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-10-6-4-5-7-12(10)8-11(2)14-13(15)9-16-3/h4-7,11H,8-9H2,1-3H3,(H,14,15).
What are the key properties of 2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide?
2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide has a molecular weight of 221.30 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide is sourced from PubChem (CID 47062728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).