2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid

C12H15NO2 — CID 112715756

IUPAC2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid
SMILESCC1Cc2cnccc2C1C(C)C(=O)O
InChIInChI=1S/C12H15NO2/c1-7-5-9-6-13-4-3-10(9)11(7)8(2)12(14)15/h3-4,6-8,11H,5H2,1-2H3,(H,14,15)
InChIKeyDYFZJRXLVZDIMM-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.08
Rot. Bonds2

About 2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid

2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid (PubChem CID 112715756) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid.

Molecular Properties

Compound Name2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid
PubChem CID112715756
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid
SMILESCC1Cc2cnccc2C1C(C)C(=O)O
InChIInChI=1S/C12H15NO2/c1-7-5-9-6-13-4-3-10(9)11(7)8(2)12(14)15/h3-4,6-8,11H,5H2,1-2H3,(H,14,15)
InChIKeyDYFZJRXLVZDIMM-UHFFFAOYSA-N
XLogP2.08
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid?
The IUPAC name of 2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid (CID 112715756) is 2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid.
What is the SMILES notation for 2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid?
The canonical SMILES for 2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid is CC1Cc2cnccc2C1C(C)C(=O)O.
What is the InChIKey of 2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid?
The InChIKey is DYFZJRXLVZDIMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-7-5-9-6-13-4-3-10(9)11(7)8(2)12(14)15/h3-4,6-8,11H,5H2,1-2H3,(H,14,15).
What are the key properties of 2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid?
2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid has a molecular weight of 205.26 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)propanoic acid is sourced from PubChem (CID 112715756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).