2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide

C14H21NO3 — CID 165397261

IUPAC2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide
SMILESCCOc1cc(C(C)C)ccc1COCC(N)=O
InChIInChI=1S/C14H21NO3/c1-4-18-13-7-11(10(2)3)5-6-12(13)8-17-9-14(15)16/h5-7,10H,4,8-9H2,1-3H3,(H2,15,16)
InChIKeySHANJWQLVARYHD-UHFFFAOYSA-N
MW251.33 g/mol
LogP2.21
Rot. Bonds7

About 2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide

2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide (PubChem CID 165397261) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide.

Molecular Properties

Compound Name2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide
PubChem CID165397261
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide
SMILESCCOc1cc(C(C)C)ccc1COCC(N)=O
InChIInChI=1S/C14H21NO3/c1-4-18-13-7-11(10(2)3)5-6-12(13)8-17-9-14(15)16/h5-7,10H,4,8-9H2,1-3H3,(H2,15,16)
InChIKeySHANJWQLVARYHD-UHFFFAOYSA-N
XLogP2.21
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]acetate
CID 130325605
2-(2-methoxy-4-propan-2-ylphenyl)acetamide
CID 82492357
2-[2-amino-2-[2,4-di(propan-2-yl)phenyl]ethoxy]acetamide
CID 61328573
2-(3-ethoxy-4-ethylphenoxy)acetamide
CID 141024835
2-ethoxy-1-methoxy-4-propan-2-ylbenzene
CID 22087689
2-(2-bromo-4-propan-2-ylphenoxy)acetamide
CID 894118
2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]-N-methylacetohydrazide
CID 116845331
1-[4-ethoxy-3-(ethoxymethyl)phenyl]ethanamine
CID 60861720
2-(2-ethoxy-4-methylphenyl)acetamide
CID 146656384
2-[2-amino-2-(4-ethoxyphenyl)ethoxy]acetamide
CID 61327412
2-(5-propan-2-yl-2-propoxyphenyl)acetic acid
CID 82054018
1-bromo-3-[4-(difluoromethyl)-2-ethoxyphenyl]propan-2-one
CID 134616696

Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide?
The IUPAC name of 2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide (CID 165397261) is 2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide.
What is the SMILES notation for 2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide?
The canonical SMILES for 2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide is CCOc1cc(C(C)C)ccc1COCC(N)=O.
What is the InChIKey of 2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide?
The InChIKey is SHANJWQLVARYHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-4-18-13-7-11(10(2)3)5-6-12(13)8-17-9-14(15)16/h5-7,10H,4,8-9H2,1-3H3,(H2,15,16).
What are the key properties of 2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide?
2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide has a molecular weight of 251.33 g/mol, XLogP of 2.21, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethoxy-4-propan-2-ylphenyl)methoxy]acetamide is sourced from PubChem (CID 165397261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).