ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate

C12H15NO2 — CID 71747575

IUPACethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate
SMILESCCOC(=O)c1c(C)ncc2c1CCC2
InChIInChI=1S/C12H15NO2/c1-3-15-12(14)11-8(2)13-7-9-5-4-6-10(9)11/h7H,3-6H2,1-2H3
InChIKeyWTNGVRQBYLMWCZ-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.06
Rot. Bonds2

About ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate

ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate (PubChem CID 71747575) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate.

Molecular Properties

Compound Nameethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate
PubChem CID71747575
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Nameethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate
SMILESCCOC(=O)c1c(C)ncc2c1CCC2
InChIInChI=1S/C12H15NO2/c1-3-15-12(14)11-8(2)13-7-9-5-4-6-10(9)11/h7H,3-6H2,1-2H3
InChIKeyWTNGVRQBYLMWCZ-UHFFFAOYSA-N
XLogP2.06
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 102151340
ethyl 4-(8-oxo-6,7-dihydro-5H-quinazolin-2-yl)benzoate
CID 59558433
ethyl 4,5-dioxo-1,2,3,6,7,8-hexahydroacridine-9-carboxylate
CID 14910849
ethyl 5-cyano-3-hydroxy-2-methylpyridine-4-carboxylate
CID 15599062
3-acetyl-5-ethoxycarbonyl-2-methylpyridine-4-carboxylic acid
CID 24973251
ethyl 2-acetamido-7-[(2-acetamido-3-ethoxycarbonyl-5,6-dihydro-4H-1-benzothiophen-7-ylidene)hydrazinylidene]-5,6-dihydro-4H-1-benzothiophene-3-carboxylate
CID 4872732
3-ethoxycarbonyl-2-hydroxy-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
CID 46741372
ethyl 8-methoxy-2,7-dimethyl-5H-chromeno[3,4-c]pyridine-1-carboxylate
CID 10638912
ethyl 1,8,10-triazatricyclo[7.3.0.02,6]dodeca-2(6),7,9,11-tetraene-11-carboxylate
CID 103200745
ethyl 2-hydrazinyl-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
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ethyl 3,6-dimethylisoquinoline-4-carboxylate
CID 132578243

Frequently Asked Questions

What is the IUPAC name of ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate?
The IUPAC name of ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate (CID 71747575) is ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate.
What is the SMILES notation for ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate?
The canonical SMILES for ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate is CCOC(=O)c1c(C)ncc2c1CCC2.
What is the InChIKey of ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate?
The InChIKey is WTNGVRQBYLMWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-3-15-12(14)11-8(2)13-7-9-5-4-6-10(9)11/h7H,3-6H2,1-2H3.
What are the key properties of ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate?
ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate has a molecular weight of 205.26 g/mol, XLogP of 2.06, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carboxylate is sourced from PubChem (CID 71747575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).