2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid

C12H15NO2 — CID 115375610

IUPAC2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid
SMILESCc1cncc(C2CCCC2C(=O)O)c1
InChIInChI=1S/C12H15NO2/c1-8-5-9(7-13-6-8)10-3-2-4-11(10)12(14)15/h5-7,10-11H,2-4H2,1H3,(H,14,15)
InChIKeyZJMNCTZNEAIWJG-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.36
Rot. Bonds2

About 2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid

2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid (PubChem CID 115375610) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid
PubChem CID115375610
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid
SMILESCc1cncc(C2CCCC2C(=O)O)c1
InChIInChI=1S/C12H15NO2/c1-8-5-9(7-13-6-8)10-3-2-4-11(10)12(14)15/h5-7,10-11H,2-4H2,1H3,(H,14,15)
InChIKeyZJMNCTZNEAIWJG-UHFFFAOYSA-N
XLogP2.36
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 ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-2-(5-methyl-3-pyridinyl)cyclohexane-1-carboxylic acid
CID 113297402
4-tert-butyl-2-(5-methyl-3-pyridinyl)cyclohexane-1-carboxylic acid
CID 115375614
4,4-dimethyl-2-(5-methyl-3-pyridinyl)cyclohexane-1-carboxylic acid
CID 113297404
trans-(1R,2R)-2-(4-methylphenyl)cyclohexane-1-carboxylic acid
CID 54256967
2-(6-methyl-3-pyridinyl)cyclohexane-1-carboxylic acid
CID 81008761
N-ethyl-2-(5-methyl-3-pyridinyl)cyclopentan-1-amine
CID 115375195
N-methyl-2-(5-methyl-3-pyridinyl)cycloheptan-1-amine
CID 115375197
3-methyl-5-(3-methylpiperidin-4-yl)pyridine
CID 114502148
2-(6-methyl-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid
CID 43379455
2-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)cyclopentane-1-carboxylic acid
CID 103979426
2-(3-fluoro-4-methoxyphenyl)cyclopentane-1-carboxylic acid
CID 81009100
N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine
CID 115375676

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid?
The IUPAC name of 2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid (CID 115375610) is 2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid is Cc1cncc(C2CCCC2C(=O)O)c1.
What is the InChIKey of 2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid?
The InChIKey is ZJMNCTZNEAIWJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-8-5-9(7-13-6-8)10-3-2-4-11(10)12(14)15/h5-7,10-11H,2-4H2,1H3,(H,14,15).
What are the key properties of 2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid?
2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid has a molecular weight of 205.26 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-3-pyridinyl)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 115375610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).