N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide

C13H19NO3 — CID 112686280

IUPACN-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide
SMILESCCOCc1ccccc1NC(=O)C(C)OC
InChIInChI=1S/C13H19NO3/c1-4-17-9-11-7-5-6-8-12(11)14-13(15)10(2)16-3/h5-8,10H,4,9H2,1-3H3,(H,14,15)
InChIKeyIBYJZAIZMAJVIV-UHFFFAOYSA-N
MW237.30 g/mol
LogP2.20
Rot. Bonds6

About N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide

N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide (PubChem CID 112686280) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide.

Molecular Properties

Compound NameN-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide
PubChem CID112686280
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC NameN-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide
SMILESCCOCc1ccccc1NC(=O)C(C)OC
InChIInChI=1S/C13H19NO3/c1-4-17-9-11-7-5-6-8-12(11)14-13(15)10(2)16-3/h5-8,10H,4,9H2,1-3H3,(H,14,15)
InChIKeyIBYJZAIZMAJVIV-UHFFFAOYSA-N
XLogP2.20
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(diethylaminomethyl)phenyl]-2-methoxypropanamide
CID 112685894
6-amino-N-[2-(ethoxymethyl)phenyl]-2-methylheptanamide
CID 65290260
(2S)-2-(benzenesulfonamido)-N-[2-(ethoxymethyl)phenyl]propanamide
CID 86826290
3-[2-(ethoxymethyl)phenyl]-1-(2-hydroxypropyl)-1-propan-2-ylurea
CID 111754728
1-[2-(ethoxymethyl)phenyl]-3-(3-hydroxybutyl)urea
CID 111336885
2-methoxy-N-(2-propan-2-ylphenyl)propanamide
CID 86811936
1-[2-(ethoxymethyl)phenyl]-3-(2-hydroxy-3,3-dimethylbutyl)urea
CID 111431488
2-(2-methoxypropanoylamino)-N-methylbenzamide
CID 47302363
N-(2-ethylphenyl)-2-methylbutanamide
CID 3140517
1-[2-(ethoxymethyl)phenyl]-3-hexylurea
CID 60562677
1-[2-(ethoxymethyl)phenyl]-3-(5-methoxypentyl)urea
CID 86871424
(2R)-2-amino-N-[2-(methoxymethyl)phenyl]propanamide;hydrochloride
CID 119288747

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide?
The IUPAC name of N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide (CID 112686280) is N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide.
What is the SMILES notation for N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide?
The canonical SMILES for N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide is CCOCc1ccccc1NC(=O)C(C)OC.
What is the InChIKey of N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide?
The InChIKey is IBYJZAIZMAJVIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-4-17-9-11-7-5-6-8-12(11)14-13(15)10(2)16-3/h5-8,10H,4,9H2,1-3H3,(H,14,15).
What are the key properties of N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide?
N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide has a molecular weight of 237.30 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide is sourced from PubChem (CID 112686280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).