4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide

C15H15NO3 — CID 55182876

IUPAC4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide
SMILESC[C@@H](O)c1ccccc1Oc1ccc(C(N)=O)cc1
InChIInChI=1S/C15H15NO3/c1-10(17)13-4-2-3-5-14(13)19-12-8-6-11(7-9-12)15(16)18/h2-10,17H,1H3,(H2,16,18)/t10-/m1/s1
InChIKeyLBROZDWCDAVFNL-SNVBAGLBSA-N
MW257.29 g/mol
LogP2.63
Rot. Bonds4

About 4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide

4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide (PubChem CID 55182876) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide.

Molecular Properties

Compound Name4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide
PubChem CID55182876
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide
SMILESC[C@@H](O)c1ccccc1Oc1ccc(C(N)=O)cc1
InChIInChI=1S/C15H15NO3/c1-10(17)13-4-2-3-5-14(13)19-12-8-6-11(7-9-12)15(16)18/h2-10,17H,1H3,(H2,16,18)/t10-/m1/s1
InChIKeyLBROZDWCDAVFNL-SNVBAGLBSA-N
XLogP2.63
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-[(1R)-1-hydroxypropyl]phenoxy]benzamide
CID 103960520
1-[2-(4-tert-butylphenoxy)phenyl]ethanol
CID 43510250
4-[2-(aminomethyl)phenoxy]benzamide
CID 28824744
4-[2-(hydroxymethyl)phenoxy]benzamide
CID 28946171
4-(2-cyanophenoxy)benzamide
CID 28825078
4-(4-carbamoylphenoxy)benzamide
CID 156597124
4-[2-chloro-4-(1-hydroxyethyl)phenoxy]benzamide
CID 62911692
1-[2-(3,4-dichlorophenoxy)phenyl]ethanol
CID 54898383
4-(4-propan-2-ylphenoxy)benzamide
CID 142414866
4-[4-[1-[2-(difluoromethoxy)phenyl]propylcarbamoyl]phenoxy]benzamide
CID 56545716
4-[4-bromo-2-[1-(methylamino)ethyl]phenoxy]benzamide
CID 82955481
N-methylsulfonyl-4-(2-propan-2-ylphenoxy)benzamide
CID 66767113

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide?
The IUPAC name of 4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide (CID 55182876) is 4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide.
What is the SMILES notation for 4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide?
The canonical SMILES for 4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide is C[C@@H](O)c1ccccc1Oc1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide?
The InChIKey is LBROZDWCDAVFNL-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H15NO3/c1-10(17)13-4-2-3-5-14(13)19-12-8-6-11(7-9-12)15(16)18/h2-10,17H,1H3,(H2,16,18)/t10-/m1/s1.
What are the key properties of 4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide?
4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide has a molecular weight of 257.29 g/mol, XLogP of 2.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(1R)-1-hydroxyethyl]phenoxy]benzamide is sourced from PubChem (CID 55182876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).