3-pyridin-3-ylcyclopentan-1-one

C10H11NO — CID 59265971

IUPAC3-pyridin-3-ylcyclopentan-1-one
SMILESO=C1CCC(c2cccnc2)C1
InChIInChI=1S/C10H11NO/c12-10-4-3-8(6-10)9-2-1-5-11-7-9/h1-2,5,7-8H,3-4,6H2
InChIKeyLPXISQZPQARANK-UHFFFAOYSA-N
MW161.20 g/mol
LogP1.92
Rot. Bonds1

About 3-pyridin-3-ylcyclopentan-1-one

3-pyridin-3-ylcyclopentan-1-one (PubChem CID 59265971) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 3-pyridin-3-ylcyclopentan-1-one.

Molecular Properties

Compound Name3-pyridin-3-ylcyclopentan-1-one
PubChem CID59265971
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name3-pyridin-3-ylcyclopentan-1-one
SMILESO=C1CCC(c2cccnc2)C1
InChIInChI=1S/C10H11NO/c12-10-4-3-8(6-10)9-2-1-5-11-7-9/h1-2,5,7-8H,3-4,6H2
InChIKeyLPXISQZPQARANK-UHFFFAOYSA-N
XLogP1.92
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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6-pyridin-3-yldiazinan-3-one
CID 20559353
4,4-dimethyl-3-pyridin-3-ylcyclohexan-1-one
CID 165497054
cis-(2S,4S)-2-acetyl-4-pyridin-3-ylcyclohexan-1-one
CID 129387672
3-pyridin-3-yl-3,4-dihydro-2H-pyridin-5-one
CID 174858264
6-pyridin-3-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine
CID 82289305
3-isoquinolin-8-ylcyclopentan-1-one
CID 103144157
3-[3-(3,5-dipyridin-3-ylcyclohexyl)-5-pyridin-3-ylcyclohexyl]pyridine
CID 58652188
3-pyrimidin-5-ylcycloheptan-1-one
CID 64505980
3-piperidin-4-ylpyridine;dihydrochloride
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4-pyridin-3-ylcyclohexane-1-carboxylic acid
CID 82282997

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-3-ylcyclopentan-1-one?
The IUPAC name of 3-pyridin-3-ylcyclopentan-1-one (CID 59265971) is 3-pyridin-3-ylcyclopentan-1-one.
What is the SMILES notation for 3-pyridin-3-ylcyclopentan-1-one?
The canonical SMILES for 3-pyridin-3-ylcyclopentan-1-one is O=C1CCC(c2cccnc2)C1.
What is the InChIKey of 3-pyridin-3-ylcyclopentan-1-one?
The InChIKey is LPXISQZPQARANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c12-10-4-3-8(6-10)9-2-1-5-11-7-9/h1-2,5,7-8H,3-4,6H2.
What are the key properties of 3-pyridin-3-ylcyclopentan-1-one?
3-pyridin-3-ylcyclopentan-1-one has a molecular weight of 161.20 g/mol, XLogP of 1.92, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-3-ylcyclopentan-1-one is sourced from PubChem (CID 59265971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).