7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid

C10H9NO2 — CID 160512752

IUPAC7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid
SMILESCC1=CCc2c(C(=O)O)ccnc21
InChIInChI=1S/C10H9NO2/c1-6-2-3-7-8(10(12)13)4-5-11-9(6)7/h2,4-5H,3H2,1H3,(H,12,13)
InChIKeyCRDFFPHFSRZWBK-UHFFFAOYSA-N
MW175.19 g/mol
LogP1.74
Rot. Bonds1

About 7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid

7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid (PubChem CID 160512752) has the molecular formula C10H9NO2 and a molecular weight of 175.19 g/mol. Its IUPAC name is 7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid
PubChem CID160512752
Molecular FormulaC10H9NO2
Molecular Weight175.19 g/mol
Exact Mass175.06
IUPAC Name7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid
SMILESCC1=CCc2c(C(=O)O)ccnc21
InChIInChI=1S/C10H9NO2/c1-6-2-3-7-8(10(12)13)4-5-11-9(6)7/h2,4-5H,3H2,1H3,(H,12,13)
InChIKeyCRDFFPHFSRZWBK-UHFFFAOYSA-N
XLogP1.74
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-2-phenylpyridine-4-carboxylic acid
CID 83916989
3-amino-2-methylpyridine-4-carboxylic acid
CID 14447106
6-ethyl-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 160512753
6,8-dihydro-5H-pyrano[3,4-b]pyridine-4-carboxylic acid
CID 84718083
3-methyl-2-(trifluoromethyl)pyridine-4-carboxylic acid
CID 90460143
2-(2,3-dichlorophenyl)-3-methylpyridine-4-carboxylic acid
CID 170837701
3-methyl-2-(6-oxo-1H-pyridin-3-yl)pyridine-4-carboxylic acid
CID 154360310
6-[(4-methylphenoxy)methyl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 147530025
7-methyl-1,8-naphthyridine-4-carboxylic acid
CID 12528926
thieno[2,3-b]pyridine-4-carboxylic acid
CID 54059213
3-fluoro-2-(4-methylpiperazin-1-yl)pyridine-4-carboxylic acid
CID 105381703
1-methyl-2,3-dihydropyrrolo[3,2-b]pyridine-7-carboxylic acid
CID 84656372

Frequently Asked Questions

What is the IUPAC name of 7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid?
The IUPAC name of 7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid (CID 160512752) is 7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid.
What is the SMILES notation for 7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid?
The canonical SMILES for 7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid is CC1=CCc2c(C(=O)O)ccnc21.
What is the InChIKey of 7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid?
The InChIKey is CRDFFPHFSRZWBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2/c1-6-2-3-7-8(10(12)13)4-5-11-9(6)7/h2,4-5H,3H2,1H3,(H,12,13).
What are the key properties of 7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid?
7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid has a molecular weight of 175.19 g/mol, XLogP of 1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-5H-cyclopenta[b]pyridine-4-carboxylic acid is sourced from PubChem (CID 160512752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).