2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide

C11H15NO3 — CID 57328061

IUPAC2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide
SMILESCC[C@H](CO)NC(=O)c1ccccc1O
InChIInChI=1S/C11H15NO3/c1-2-8(7-13)12-11(15)9-5-3-4-6-10(9)14/h3-6,8,13-14H,2,7H2,1H3,(H,12,15)/t8-/m1/s1
InChIKeyKXERVAKUDTXUMX-MRVPVSSYSA-N
MW209.25 g/mol
LogP0.89
Rot. Bonds4

About 2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide

2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide (PubChem CID 57328061) has the molecular formula C11H15NO3 and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide.

Molecular Properties

Compound Name2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide
PubChem CID57328061
Molecular FormulaC11H15NO3
Molecular Weight209.25 g/mol
Exact Mass209.11
IUPAC Name2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide
SMILESCC[C@H](CO)NC(=O)c1ccccc1O
InChIInChI=1S/C11H15NO3/c1-2-8(7-13)12-11(15)9-5-3-4-6-10(9)14/h3-6,8,13-14H,2,7H2,1H3,(H,12,15)/t8-/m1/s1
InChIKeyKXERVAKUDTXUMX-MRVPVSSYSA-N
XLogP0.89
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide?
The IUPAC name of 2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide (CID 57328061) is 2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide.
What is the SMILES notation for 2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide?
The canonical SMILES for 2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide is CC[C@H](CO)NC(=O)c1ccccc1O.
What is the InChIKey of 2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide?
The InChIKey is KXERVAKUDTXUMX-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-2-8(7-13)12-11(15)9-5-3-4-6-10(9)14/h3-6,8,13-14H,2,7H2,1H3,(H,12,15)/t8-/m1/s1.
What are the key properties of 2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide?
2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide has a molecular weight of 209.25 g/mol, XLogP of 0.89, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]benzamide is sourced from PubChem (CID 57328061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).