2-(2-methoxy-4-propan-2-ylphenyl)acetamide

C12H17NO2 — CID 82492357

IUPAC2-(2-methoxy-4-propan-2-ylphenyl)acetamide
SMILESCOc1cc(C(C)C)ccc1CC(N)=O
InChIInChI=1S/C12H17NO2/c1-8(2)9-4-5-10(7-12(13)14)11(6-9)15-3/h4-6,8H,7H2,1-3H3,(H2,13,14)
InChIKeySTKJRIQPPFUYII-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.85
Rot. Bonds4

About 2-(2-methoxy-4-propan-2-ylphenyl)acetamide

2-(2-methoxy-4-propan-2-ylphenyl)acetamide (PubChem CID 82492357) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 2-(2-methoxy-4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-methoxy-4-propan-2-ylphenyl)acetamide
PubChem CID82492357
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name2-(2-methoxy-4-propan-2-ylphenyl)acetamide
SMILESCOc1cc(C(C)C)ccc1CC(N)=O
InChIInChI=1S/C12H17NO2/c1-8(2)9-4-5-10(7-12(13)14)11(6-9)15-3/h4-6,8H,7H2,1-3H3,(H2,13,14)
InChIKeySTKJRIQPPFUYII-UHFFFAOYSA-N
XLogP1.85
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1-ethyl-2-methoxy-4-propan-2-ylbenzene
CID 166091157
2-amino-N-[(2-methoxy-4-propan-2-ylphenyl)methyl]propanamide
CID 115152376
N-[(2-methoxy-4-propan-2-ylphenyl)methyl]carbamoyl chloride
CID 115194650
ethyl N-[(2-methoxy-4-propan-2-ylphenyl)methyl]carbamate
CID 110782911
1-amino-3-(2-methoxy-4-propan-2-ylphenyl)propan-2-ol
CID 116859156
1-[(2-methoxy-4-propan-2-ylphenyl)methylamino]propan-2-one
CID 115234731
2-(2-methoxy-4-propan-2-ylphenyl)-N-prop-2-enylacetamide
CID 110769385
1-[2-(2-methoxy-4-propan-2-ylphenyl)ethyl-methylamino]propan-2-one
CID 115235168
1-[4-[2-(2-methoxy-4-propan-2-ylphenyl)acetyl]piperazin-1-yl]-3-methylbutan-1-one
CID 110800977
2-(2-methoxy-4-propan-2-ylphenyl)ethylcarbamothioic S-acid
CID 115170285
1-(2-methoxy-4-propan-2-ylphenyl)pentan-3-amine
CID 112513250
ethyl 2-methoxy-4-propan-2-ylbenzoate
CID 116964804

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-4-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(2-methoxy-4-propan-2-ylphenyl)acetamide (CID 82492357) is 2-(2-methoxy-4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(2-methoxy-4-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(2-methoxy-4-propan-2-ylphenyl)acetamide is COc1cc(C(C)C)ccc1CC(N)=O.
What is the InChIKey of 2-(2-methoxy-4-propan-2-ylphenyl)acetamide?
The InChIKey is STKJRIQPPFUYII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-8(2)9-4-5-10(7-12(13)14)11(6-9)15-3/h4-6,8H,7H2,1-3H3,(H2,13,14).
What are the key properties of 2-(2-methoxy-4-propan-2-ylphenyl)acetamide?
2-(2-methoxy-4-propan-2-ylphenyl)acetamide has a molecular weight of 207.27 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 82492357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).