3-propyl-5H-chromeno[2,3-b]pyridine

C15H15NO — CID 167276732

IUPAC3-propyl-5H-chromeno[2,3-b]pyridine
SMILESCCCc1cnc2c(c1)Cc1ccccc1O2
InChIInChI=1S/C15H15NO/c1-2-5-11-8-13-9-12-6-3-4-7-14(12)17-15(13)16-10-11/h3-4,6-8,10H,2,5,9H2,1H3
InChIKeyURCARHYXWQCZAI-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.73
Rot. Bonds2

About 3-propyl-5H-chromeno[2,3-b]pyridine

3-propyl-5H-chromeno[2,3-b]pyridine (PubChem CID 167276732) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 3-propyl-5H-chromeno[2,3-b]pyridine.

Molecular Properties

Compound Name3-propyl-5H-chromeno[2,3-b]pyridine
PubChem CID167276732
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name3-propyl-5H-chromeno[2,3-b]pyridine
SMILESCCCc1cnc2c(c1)Cc1ccccc1O2
InChIInChI=1S/C15H15NO/c1-2-5-11-8-13-9-12-6-3-4-7-14(12)17-15(13)16-10-11/h3-4,6-8,10H,2,5,9H2,1H3
InChIKeyURCARHYXWQCZAI-UHFFFAOYSA-N
XLogP3.73
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-propyl-5H-chromeno[2,3-b]pyridine?
The IUPAC name of 3-propyl-5H-chromeno[2,3-b]pyridine (CID 167276732) is 3-propyl-5H-chromeno[2,3-b]pyridine.
What is the SMILES notation for 3-propyl-5H-chromeno[2,3-b]pyridine?
The canonical SMILES for 3-propyl-5H-chromeno[2,3-b]pyridine is CCCc1cnc2c(c1)Cc1ccccc1O2.
What is the InChIKey of 3-propyl-5H-chromeno[2,3-b]pyridine?
The InChIKey is URCARHYXWQCZAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-2-5-11-8-13-9-12-6-3-4-7-14(12)17-15(13)16-10-11/h3-4,6-8,10H,2,5,9H2,1H3.
What are the key properties of 3-propyl-5H-chromeno[2,3-b]pyridine?
3-propyl-5H-chromeno[2,3-b]pyridine has a molecular weight of 225.29 g/mol, XLogP of 3.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propyl-5H-chromeno[2,3-b]pyridine is sourced from PubChem (CID 167276732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).