2-[4-(hydroxymethyl)phenoxy]propanamide

C10H13NO3 — CID 43082830

IUPAC2-[4-(hydroxymethyl)phenoxy]propanamide
SMILESCC(Oc1ccc(CO)cc1)C(N)=O
InChIInChI=1S/C10H13NO3/c1-7(10(11)13)14-9-4-2-8(6-12)3-5-9/h2-5,7,12H,6H2,1H3,(H2,11,13)
InChIKeyOOMIBLHEQOPGLK-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.43
Rot. Bonds4

About 2-[4-(hydroxymethyl)phenoxy]propanamide

2-[4-(hydroxymethyl)phenoxy]propanamide (PubChem CID 43082830) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is 2-[4-(hydroxymethyl)phenoxy]propanamide.

Molecular Properties

Compound Name2-[4-(hydroxymethyl)phenoxy]propanamide
PubChem CID43082830
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Name2-[4-(hydroxymethyl)phenoxy]propanamide
SMILESCC(Oc1ccc(CO)cc1)C(N)=O
InChIInChI=1S/C10H13NO3/c1-7(10(11)13)14-9-4-2-8(6-12)3-5-9/h2-5,7,12H,6H2,1H3,(H2,11,13)
InChIKeyOOMIBLHEQOPGLK-UHFFFAOYSA-N
XLogP0.43
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 ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (2R)-2-[4-(hydroxymethyl)phenoxy]propanoate
CID 103337931
N-carbamoyl-2-[4-(hydroxymethyl)phenoxy]propanamide
CID 43082828
(2R)-2-[4-(3-oxobutyl)phenoxy]propanamide
CID 28825316
(2R)-2-(4-hydroxyphenoxy)propanamide
CID 67641252
(2R)-2-(4-bromophenoxy)propanamide
CID 974910
2-[4-(1-hydroxyethyl)phenoxy]propanamide
CID 43503658
2-[4-(hydroxymethyl)phenoxy]-3-methylbutanoic acid
CID 60705654
(3S)-3-[4-(hydroxymethyl)phenoxy]butanoic acid
CID 103547969
N-(ethylcarbamoyl)-2-[4-(hydroxymethyl)phenoxy]propanamide
CID 43082829
2-[4-(hydroxymethyl)phenoxy]-1-morpholin-4-ylpropan-1-one
CID 43083069
2-[4-(hydroxymethyl)phenoxy]pentanoic acid
CID 83037900
methyl (2R)-2-[4-(2-hydroxyethyl)phenoxy]propanoate
CID 107708333

Frequently Asked Questions

What is the IUPAC name of 2-[4-(hydroxymethyl)phenoxy]propanamide?
The IUPAC name of 2-[4-(hydroxymethyl)phenoxy]propanamide (CID 43082830) is 2-[4-(hydroxymethyl)phenoxy]propanamide.
What is the SMILES notation for 2-[4-(hydroxymethyl)phenoxy]propanamide?
The canonical SMILES for 2-[4-(hydroxymethyl)phenoxy]propanamide is CC(Oc1ccc(CO)cc1)C(N)=O.
What is the InChIKey of 2-[4-(hydroxymethyl)phenoxy]propanamide?
The InChIKey is OOMIBLHEQOPGLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c1-7(10(11)13)14-9-4-2-8(6-12)3-5-9/h2-5,7,12H,6H2,1H3,(H2,11,13).
What are the key properties of 2-[4-(hydroxymethyl)phenoxy]propanamide?
2-[4-(hydroxymethyl)phenoxy]propanamide has a molecular weight of 195.22 g/mol, XLogP of 0.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(hydroxymethyl)phenoxy]propanamide is sourced from PubChem (CID 43082830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).