2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol

C11H12N2O — CID 2774691

IUPAC2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol
SMILESCc1ccc(C)n1-c1ncccc1O
InChIInChI=1S/C11H12N2O/c1-8-5-6-9(2)13(8)11-10(14)4-3-7-12-11/h3-7,14H,1-2H3
InChIKeyHHDMLMOSQQBISY-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.19
Rot. Bonds1

About 2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol

2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol (PubChem CID 2774691) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol.

Molecular Properties

Compound Name2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol
PubChem CID2774691
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol
SMILESCc1ccc(C)n1-c1ncccc1O
InChIInChI=1S/C11H12N2O/c1-8-5-6-9(2)13(8)11-10(14)4-3-7-12-11/h3-7,14H,1-2H3
InChIKeyHHDMLMOSQQBISY-UHFFFAOYSA-N
XLogP2.19
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'pyrrole_A(118)', 'substructure': 'N/A'}

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Related Compounds

2-Amino-3-Hydroxypyridine
CID 28114
2-((Dimethylamino)methyl)pyridin-3-ol
CID 75108
3-Hydroxy-2-(pyrrolidinomethyl)-pyridine
CID 251555
2-((Diethylamino)methyl)-3-pyridinol
CID 252255
2-Amino-5-hydroxypyridine
CID 4231972
2-(Pyridin-2-ylamino)phenol
CID 242279
2-[[Ethyl(methyl)amino]methyl]pyridin-3-ol
CID 101010642
Imidazo(1,2-a)pyridin-8-ol
CID 2764453
Urea, N-(3-hydroxy-2-pyridinyl)-N'-phenyl-
CID 1278719
2-(8-Hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile
CID 13338266
6-(Piperazin-1-yl)pyridin-3-ol
CID 17819954
2-[[Butyl(methyl)amino]methyl]pyridin-3-ol
CID 21154991

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol?
The IUPAC name of 2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol (CID 2774691) is 2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol.
What is the SMILES notation for 2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol?
The canonical SMILES for 2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol is Cc1ccc(C)n1-c1ncccc1O.
What is the InChIKey of 2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol?
The InChIKey is HHDMLMOSQQBISY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-8-5-6-9(2)13(8)11-10(14)4-3-7-12-11/h3-7,14H,1-2H3.
What are the key properties of 2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol?
2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol has a molecular weight of 188.23 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpyrrol-1-yl)pyridin-3-ol is sourced from PubChem (CID 2774691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).