2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid

C17H17NO3 — CID 10423951

IUPAC2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid
SMILESCCc1ccc2c(n1)Oc1ccc(C(C)C(=O)O)cc1C2
InChIInChI=1S/C17H17NO3/c1-3-14-6-4-12-9-13-8-11(10(2)17(19)20)5-7-15(13)21-16(12)18-14/h4-8,10H,3,9H2,1-2H3,(H,19,20)
InChIKeyOZUDCDGAEOULAG-UHFFFAOYSA-N
MW283.33 g/mol
LogP3.53
Rot. Bonds3

About 2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid

2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid (PubChem CID 10423951) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is 2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid.

Molecular Properties

Compound Name2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid
PubChem CID10423951
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC Name2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid
SMILESCCc1ccc2c(n1)Oc1ccc(C(C)C(=O)O)cc1C2
InChIInChI=1S/C17H17NO3/c1-3-14-6-4-12-9-13-8-11(10(2)17(19)20)5-7-15(13)21-16(12)18-14/h4-8,10H,3,9H2,1-2H3,(H,19,20)
InChIKeyOZUDCDGAEOULAG-UHFFFAOYSA-N
XLogP3.53
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid 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 2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid?
The IUPAC name of 2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid (CID 10423951) is 2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid.
What is the SMILES notation for 2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid?
The canonical SMILES for 2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid is CCc1ccc2c(n1)Oc1ccc(C(C)C(=O)O)cc1C2.
What is the InChIKey of 2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid?
The InChIKey is OZUDCDGAEOULAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO3/c1-3-14-6-4-12-9-13-8-11(10(2)17(19)20)5-7-15(13)21-16(12)18-14/h4-8,10H,3,9H2,1-2H3,(H,19,20).
What are the key properties of 2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid?
2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid has a molecular weight of 283.33 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid is sourced from PubChem (CID 10423951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).