2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone

C13H17NO — CID 63555756

IUPAC2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone
SMILESCc1cccc(C(=O)CC2CCCC2)n1
InChIInChI=1S/C13H17NO/c1-10-5-4-8-12(14-10)13(15)9-11-6-2-3-7-11/h4-5,8,11H,2-3,6-7,9H2,1H3
InChIKeyKMMVWLKFIKUHEY-UHFFFAOYSA-N
MW203.29 g/mol
LogP3.15
Rot. Bonds3

About 2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone

2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone (PubChem CID 63555756) has the molecular formula C13H17NO and a molecular weight of 203.29 g/mol. Its IUPAC name is 2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone.

Molecular Properties

Compound Name2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone
PubChem CID63555756
Molecular FormulaC13H17NO
Molecular Weight203.29 g/mol
Exact Mass203.13
IUPAC Name2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone
SMILESCc1cccc(C(=O)CC2CCCC2)n1
InChIInChI=1S/C13H17NO/c1-10-5-4-8-12(14-10)13(15)9-11-6-2-3-7-11/h4-5,8,11H,2-3,6-7,9H2,1H3
InChIKeyKMMVWLKFIKUHEY-UHFFFAOYSA-N
XLogP3.15
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclohexyl-1-(2-methylpyrimidin-4-yl)ethanone
CID 115529765
2-[(4S)-1-(6-methylpyridine-2-carbonyl)azepan-4-yl]acetic acid
CID 129488825
2-cyclohexyl-1-(5-methylpyrazin-2-yl)ethanone
CID 105089049
[3-(hydroxymethyl)piperidin-1-yl]-(6-methyl-2-pyridinyl)methanone
CID 43422119
3-(6-methyl-2-pyridinyl)-3-oxopropanenitrile
CID 53435643
1-(6-methyl-2-pyridinyl)-2-methylsulfonylethanone
CID 2736945
(3-aminoazetidin-1-yl)-(6-methyl-2-pyridinyl)methanone
CID 63754551
2-cyclopentyl-1-(1-methylpyrazol-3-yl)ethanone
CID 65195587
6-[(5R,7S)-7-[2-(6-methyl-2-pyridinyl)-2-oxoethyl]-1-oxo-2-azaspiro[4.5]decan-2-yl]pyridine-2-carbonitrile
CID 58237193
[3-(bromomethyl)pyrrolidin-1-yl]-(6-methyl-2-pyridinyl)methanone
CID 80666813
4-methyl-1-(6-methyl-2-pyridinyl)pent-4-en-1-one
CID 114473556
2-cyclobutyl-1-(2-methylquinolin-6-yl)ethanone
CID 103168015

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone?
The IUPAC name of 2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone (CID 63555756) is 2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone.
What is the SMILES notation for 2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone?
The canonical SMILES for 2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone is Cc1cccc(C(=O)CC2CCCC2)n1.
What is the InChIKey of 2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone?
The InChIKey is KMMVWLKFIKUHEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-10-5-4-8-12(14-10)13(15)9-11-6-2-3-7-11/h4-5,8,11H,2-3,6-7,9H2,1H3.
What are the key properties of 2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone?
2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone has a molecular weight of 203.29 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(6-methyl-2-pyridinyl)ethanone is sourced from PubChem (CID 63555756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).