2-(2-pyridin-3-ylethyl)cyclopentan-1-one

C12H15NO — CID 79429572

IUPAC2-(2-pyridin-3-ylethyl)cyclopentan-1-one
SMILESO=C1CCCC1CCc1cccnc1
InChIInChI=1S/C12H15NO/c14-12-5-1-4-11(12)7-6-10-3-2-8-13-9-10/h2-3,8-9,11H,1,4-7H2
InChIKeySUADVNDZCXDIAT-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.38
Rot. Bonds3

About 2-(2-pyridin-3-ylethyl)cyclopentan-1-one

2-(2-pyridin-3-ylethyl)cyclopentan-1-one (PubChem CID 79429572) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 2-(2-pyridin-3-ylethyl)cyclopentan-1-one.

Molecular Properties

Compound Name2-(2-pyridin-3-ylethyl)cyclopentan-1-one
PubChem CID79429572
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name2-(2-pyridin-3-ylethyl)cyclopentan-1-one
SMILESO=C1CCCC1CCc1cccnc1
InChIInChI=1S/C12H15NO/c14-12-5-1-4-11(12)7-6-10-3-2-8-13-9-10/h2-3,8-9,11H,1,4-7H2
InChIKeySUADVNDZCXDIAT-UHFFFAOYSA-N
XLogP2.38
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-cyclobutylethyl)pyridine
CID 57204476
2-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-naphthalen-1-one
CID 79429581
trans-(2R,4R)-4-methyl-2-(pyridin-3-ylmethyl)cyclohexan-1-one
CID 124511943
2-(3-phenylpropyl)cyclotetradecan-1-one
CID 140989755
2-[2-(2-phenylethoxy)ethyl]cyclohexan-1-one
CID 141155106
1-(6-methyl-3-pyridinyl)-3-(2-pyridin-3-ylethyl)pyrrolidin-2-one
CID 91323687
4-[methyl(2-pyridin-3-ylethyl)amino]cyclohexan-1-one
CID 79119944
2-[3-(pyridin-3-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-one
CID 55201048
1-(2-pyridin-3-ylethyl)piperidin-3-ol
CID 63262678
3-(2-pyrrolidin-1-ylethyl)pyridine
CID 23273673
1-(2-pyridin-3-ylethyl)pyrrolidin-2-one
CID 59074969
argon;2-pyridin-3-ylethanol
CID 159015973

Frequently Asked Questions

What is the IUPAC name of 2-(2-pyridin-3-ylethyl)cyclopentan-1-one?
The IUPAC name of 2-(2-pyridin-3-ylethyl)cyclopentan-1-one (CID 79429572) is 2-(2-pyridin-3-ylethyl)cyclopentan-1-one.
What is the SMILES notation for 2-(2-pyridin-3-ylethyl)cyclopentan-1-one?
The canonical SMILES for 2-(2-pyridin-3-ylethyl)cyclopentan-1-one is O=C1CCCC1CCc1cccnc1.
What is the InChIKey of 2-(2-pyridin-3-ylethyl)cyclopentan-1-one?
The InChIKey is SUADVNDZCXDIAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c14-12-5-1-4-11(12)7-6-10-3-2-8-13-9-10/h2-3,8-9,11H,1,4-7H2.
What are the key properties of 2-(2-pyridin-3-ylethyl)cyclopentan-1-one?
2-(2-pyridin-3-ylethyl)cyclopentan-1-one has a molecular weight of 189.26 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyridin-3-ylethyl)cyclopentan-1-one is sourced from PubChem (CID 79429572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).