2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone

C15H21NO — CID 115786162

IUPAC2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone
SMILESCCc1ccc(CC(=O)C2(C)CCCC2)nc1
InChIInChI=1S/C15H21NO/c1-3-12-6-7-13(16-11-12)10-14(17)15(2)8-4-5-9-15/h6-7,11H,3-5,8-10H2,1-2H3
InChIKeyUVLLGDOYCCEDHM-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.34
Rot. Bonds4

About 2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone

2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone (PubChem CID 115786162) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone.

Molecular Properties

Compound Name2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone
PubChem CID115786162
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone
SMILESCCc1ccc(CC(=O)C2(C)CCCC2)nc1
InChIInChI=1S/C15H21NO/c1-3-12-6-7-13(16-11-12)10-14(17)15(2)8-4-5-9-15/h6-7,11H,3-5,8-10H2,1-2H3
InChIKeyUVLLGDOYCCEDHM-UHFFFAOYSA-N
XLogP3.34
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-aminocyclohexyl)-2-(5-ethyl-2-pyridinyl)ethanone
CID 116550422
1-(1-aminocyclopentyl)-3-(5-ethyl-2-pyridinyl)propan-2-one
CID 116578619
1-[1-(aminomethyl)cyclobutyl]-2-(5-ethyl-2-pyridinyl)ethanone
CID 116600244
2-(5-ethyl-2-pyridinyl)-1-(3-propylpiperidin-3-yl)ethanone
CID 116569629
2-(5-ethyl-2-pyridinyl)-1-(1-hydroxy-4-methylcyclohexyl)ethanone
CID 103450762
1-[1-(4-aminophenyl)cyclopropyl]-2-(5-ethyl-2-pyridinyl)ethanone
CID 116611651
1-(1-ethoxy-3-methylcyclohexyl)-2-(5-ethyl-2-pyridinyl)ethanone
CID 116749979
1-[(5-ethyl-2-pyridinyl)methyl]cycloheptan-1-ol
CID 79740505
1-(5-ethyl-2-pyridinyl)-3,3-dimethylbutan-2-one
CID 79745157
1-(5-ethyl-2-pyridinyl)-3-hydroxybutan-2-one
CID 103451397
1-(cyclohexen-1-yl)-2-(5-ethyl-2-pyridinyl)ethanone
CID 103449933
1-(5-ethyl-2-pyridinyl)-3-(propan-2-ylamino)propan-2-one
CID 116554816

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone?
The IUPAC name of 2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone (CID 115786162) is 2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone.
What is the SMILES notation for 2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone?
The canonical SMILES for 2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone is CCc1ccc(CC(=O)C2(C)CCCC2)nc1.
What is the InChIKey of 2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone?
The InChIKey is UVLLGDOYCCEDHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-3-12-6-7-13(16-11-12)10-14(17)15(2)8-4-5-9-15/h6-7,11H,3-5,8-10H2,1-2H3.
What are the key properties of 2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone?
2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone has a molecular weight of 231.34 g/mol, XLogP of 3.34, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclopentyl)ethanone is sourced from PubChem (CID 115786162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).