2-(2-hydroxyethoxy)-4-methylbenzamide

C10H13NO3 — CID 67742497

IUPAC2-(2-hydroxyethoxy)-4-methylbenzamide
SMILESCc1ccc(C(N)=O)c(OCCO)c1
InChIInChI=1S/C10H13NO3/c1-7-2-3-8(10(11)13)9(6-7)14-5-4-12/h2-3,6,12H,4-5H2,1H3,(H2,11,13)
InChIKeyXSZXZUZFGUSPIX-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.47
Rot. Bonds4

About 2-(2-hydroxyethoxy)-4-methylbenzamide

2-(2-hydroxyethoxy)-4-methylbenzamide (PubChem CID 67742497) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is 2-(2-hydroxyethoxy)-4-methylbenzamide.

Molecular Properties

Compound Name2-(2-hydroxyethoxy)-4-methylbenzamide
PubChem CID67742497
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Name2-(2-hydroxyethoxy)-4-methylbenzamide
SMILESCc1ccc(C(N)=O)c(OCCO)c1
InChIInChI=1S/C10H13NO3/c1-7-2-3-8(10(11)13)9(6-7)14-5-4-12/h2-3,6,12H,4-5H2,1H3,(H2,11,13)
InChIKeyXSZXZUZFGUSPIX-UHFFFAOYSA-N
XLogP0.47
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-aminoethoxy)-4-methylbenzamide
CID 62349382
2-(5-hydroxypentoxy)-4-methylbenzenecarbothioamide
CID 114216688
4-methyl-2-[(4-propoxyphenyl)methoxy]benzamide
CID 75396537
2-(4-aminophenoxy)-4-methylbenzamide
CID 62308033
2-[4-(aminomethyl)phenoxy]-4-methylbenzamide
CID 106485646
2-[2-(2-hydroxyethyl)phenoxy]-4-methylbenzamide
CID 107713704
4-amino-2-(5-hydroxypentoxy)benzamide
CID 106955432
2-(4-bromophenoxy)-4-methylbenzamide
CID 62308096
4-fluoro-5-(2-hydroxyethoxy)-2-methylbenzamide
CID 68606030
4-methyl-2-[2-(3-methylbutan-2-ylamino)-2-oxoethoxy]benzamide
CID 46681501
4-methyl-2-[2-(2-methylbutan-2-ylamino)-2-oxoethoxy]benzamide
CID 36578757
2-[2-(2-fluoro-4-methylanilino)-2-oxoethoxy]-4-methylbenzamide
CID 24585355

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethoxy)-4-methylbenzamide?
The IUPAC name of 2-(2-hydroxyethoxy)-4-methylbenzamide (CID 67742497) is 2-(2-hydroxyethoxy)-4-methylbenzamide.
What is the SMILES notation for 2-(2-hydroxyethoxy)-4-methylbenzamide?
The canonical SMILES for 2-(2-hydroxyethoxy)-4-methylbenzamide is Cc1ccc(C(N)=O)c(OCCO)c1.
What is the InChIKey of 2-(2-hydroxyethoxy)-4-methylbenzamide?
The InChIKey is XSZXZUZFGUSPIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c1-7-2-3-8(10(11)13)9(6-7)14-5-4-12/h2-3,6,12H,4-5H2,1H3,(H2,11,13).
What are the key properties of 2-(2-hydroxyethoxy)-4-methylbenzamide?
2-(2-hydroxyethoxy)-4-methylbenzamide has a molecular weight of 195.22 g/mol, XLogP of 0.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethoxy)-4-methylbenzamide is sourced from PubChem (CID 67742497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).