6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol

C14H13NO2 — CID 114747681

IUPAC6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol
SMILESOc1ccc(-c2cccc3c2OCCC3)nc1
InChIInChI=1S/C14H13NO2/c16-11-6-7-13(15-9-11)12-5-1-3-10-4-2-8-17-14(10)12/h1,3,5-7,9,16H,2,4,8H2
InChIKeyBJEQPGMDECCSLQ-UHFFFAOYSA-N
MW227.26 g/mol
LogP2.78
Rot. Bonds1

About 6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol

6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol (PubChem CID 114747681) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is 6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol.

Molecular Properties

Compound Name6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol
PubChem CID114747681
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC Name6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol
SMILESOc1ccc(-c2cccc3c2OCCC3)nc1
InChIInChI=1S/C14H13NO2/c16-11-6-7-13(15-9-11)12-5-1-3-10-4-2-8-17-14(10)12/h1,3,5-7,9,16H,2,4,8H2
InChIKeyBJEQPGMDECCSLQ-UHFFFAOYSA-N
XLogP2.78
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol?
The IUPAC name of 6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol (CID 114747681) is 6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol.
What is the SMILES notation for 6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol?
The canonical SMILES for 6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol is Oc1ccc(-c2cccc3c2OCCC3)nc1.
What is the InChIKey of 6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol?
The InChIKey is BJEQPGMDECCSLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2/c16-11-6-7-13(15-9-11)12-5-1-3-10-4-2-8-17-14(10)12/h1,3,5-7,9,16H,2,4,8H2.
What are the key properties of 6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol?
6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol has a molecular weight of 227.26 g/mol, XLogP of 2.78, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dihydro-2H-chromen-8-yl)pyridin-3-ol is sourced from PubChem (CID 114747681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).