3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide

C14H14N2O2 — CID 53218059

IUPAC3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1cccc(-c2ncccc2O)c1
InChIInChI=1S/C14H14N2O2/c1-16(2)14(18)11-6-3-5-10(9-11)13-12(17)7-4-8-15-13/h3-9,17H,1-2H3
InChIKeyDJJANYJKDGFBSR-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.16
Rot. Bonds2

About 3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide

3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide (PubChem CID 53218059) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide.

Molecular Properties

Compound Name3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide
PubChem CID53218059
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1cccc(-c2ncccc2O)c1
InChIInChI=1S/C14H14N2O2/c1-16(2)14(18)11-6-3-5-10(9-11)13-12(17)7-4-8-15-13/h3-9,17H,1-2H3
InChIKeyDJJANYJKDGFBSR-UHFFFAOYSA-N
XLogP2.16
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide?
The IUPAC name of 3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide (CID 53218059) is 3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide.
What is the SMILES notation for 3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide?
The canonical SMILES for 3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide is CN(C)C(=O)c1cccc(-c2ncccc2O)c1.
What is the InChIKey of 3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide?
The InChIKey is DJJANYJKDGFBSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-16(2)14(18)11-6-3-5-10(9-11)13-12(17)7-4-8-15-13/h3-9,17H,1-2H3.
What are the key properties of 3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide?
3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide has a molecular weight of 242.28 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxy-2-pyridinyl)-N,N-dimethylbenzamide is sourced from PubChem (CID 53218059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).