2-(4-methoxyphenyl)-N,N-dimethylpropanamide

C12H17NO2 — CID 20710885

IUPAC2-(4-methoxyphenyl)-N,N-dimethylpropanamide
SMILESCOc1ccc(C(C)C(=O)N(C)C)cc1
InChIInChI=1S/C12H17NO2/c1-9(12(14)13(2)3)10-5-7-11(15-4)8-6-10/h5-9H,1-4H3
InChIKeyXZCIQIWNRFWIQM-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.89
Rot. Bonds3

About 2-(4-methoxyphenyl)-N,N-dimethylpropanamide

2-(4-methoxyphenyl)-N,N-dimethylpropanamide (PubChem CID 20710885) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N,N-dimethylpropanamide
PubChem CID20710885
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name2-(4-methoxyphenyl)-N,N-dimethylpropanamide
SMILESCOc1ccc(C(C)C(=O)N(C)C)cc1
InChIInChI=1S/C12H17NO2/c1-9(12(14)13(2)3)10-5-7-11(15-4)8-6-10/h5-9H,1-4H3
InChIKeyXZCIQIWNRFWIQM-UHFFFAOYSA-N
XLogP1.89
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-(4-methoxyphenyl)propanoyl-methylamino]-2-methylpropanoic acid
CID 119228886
2-(4-methoxyphenyl)-N',N'-dimethylpropanehydrazide
CID 116848056
4-[1-(dimethylamino)-1-oxopropan-2-yl]benzoic acid;ethane
CID 143679976
2-methoxy-N-[1-(4-methoxyphenyl)ethyl]-N-methylpropanamide
CID 75493520
2-[cyclopropyl-[2-(4-methoxyphenyl)propanoyl]amino]propanoic acid
CID 119203577
(2S)-N-(2-amino-2-oxoethyl)-N-ethyl-2-(4-methoxyphenyl)propanamide
CID 100694823
N-(2-amino-2-oxoethyl)-N-ethyl-2-(4-methoxyphenyl)propanamide
CID 119039574
N-ethyl-N-(2-hydroxy-2-methylpropyl)-2-(4-methoxyphenyl)propanamide
CID 111596140
2-(4-methoxyphenyl)-N-propan-2-ylpropanamide
CID 154459065
2-[2-methoxyethyl-[2-(4-methoxyphenyl)propanoyl]amino]acetic acid
CID 119189812
1-(4-methoxyphenyl)ethanone;2-(4-methoxyphenyl)propanoic acid
CID 157331478
N-cyclohexyl-2-(6-methoxynaphthalen-2-yl)-N-methylpropanamide
CID 74853038

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N,N-dimethylpropanamide?
The IUPAC name of 2-(4-methoxyphenyl)-N,N-dimethylpropanamide (CID 20710885) is 2-(4-methoxyphenyl)-N,N-dimethylpropanamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N,N-dimethylpropanamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N,N-dimethylpropanamide is COc1ccc(C(C)C(=O)N(C)C)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N,N-dimethylpropanamide?
The InChIKey is XZCIQIWNRFWIQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-9(12(14)13(2)3)10-5-7-11(15-4)8-6-10/h5-9H,1-4H3.
What are the key properties of 2-(4-methoxyphenyl)-N,N-dimethylpropanamide?
2-(4-methoxyphenyl)-N,N-dimethylpropanamide has a molecular weight of 207.27 g/mol, XLogP of 1.89, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N,N-dimethylpropanamide is sourced from PubChem (CID 20710885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).