cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone

C16H20O — CID 65409165

IUPACcyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
SMILESO=C(C1CCCC1)C1CCc2ccccc2C1
InChIInChI=1S/C16H20O/c17-16(13-6-2-3-7-13)15-10-9-12-5-1-4-8-14(12)11-15/h1,4-5,8,13,15H,2-3,6-7,9-11H2
InChIKeyUYOTVTJAPKKPNY-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.55
Rot. Bonds2

About cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone

cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone (PubChem CID 65409165) has the molecular formula C16H20O and a molecular weight of 228.34 g/mol. Its IUPAC name is cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone.

Molecular Properties

Compound Namecyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
PubChem CID65409165
Molecular FormulaC16H20O
Molecular Weight228.34 g/mol
Exact Mass228.15
IUPAC Namecyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
SMILESO=C(C1CCCC1)C1CCc2ccccc2C1
InChIInChI=1S/C16H20O/c17-16(13-6-2-3-7-13)15-10-9-12-5-1-4-8-14(12)11-15/h1,4-5,8,13,15H,2-3,6-7,9-11H2
InChIKeyUYOTVTJAPKKPNY-UHFFFAOYSA-N
XLogP3.55
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(4-ethylcyclohexyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
CID 65408200
1,2,3,4-tetrahydronaphthalene-2-carboxylic acid;hydrochloride
CID 67808987
(2S)-1-(1,2,3,4-tetrahydronaphthalene-2-carbonyl)piperidine-2-carboxylic acid
CID 107126335
ethane;N-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 143214414
N-(2-chlorocyclohexyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 107127715
(4,4-difluorocyclohexyl)-(2,3-dihydro-1H-inden-2-yl)methanone
CID 106893040
cyclopentyl-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanone
CID 68917458
cyclopentyl(1,2,3,4-tetrahydroisoquinolin-2-ium-3-yl)methanone
CID 59078557
[(2S)-2-(pyrrolidine-1-carbonyl)-4-sulfanylidenepyrrolidin-3-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
CID 18645762
cyclohexyl(1,2,3,4-tetrahydroisoquinolin-3-yl)methanone
CID 116549688
(3,5-difluorophenyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
CID 65408772
N-(2-bromoethyl)-N-cyclobutyl-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 107127798

Frequently Asked Questions

What is the IUPAC name of cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone?
The IUPAC name of cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone (CID 65409165) is cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone.
What is the SMILES notation for cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone?
The canonical SMILES for cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone is O=C(C1CCCC1)C1CCc2ccccc2C1.
What is the InChIKey of cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone?
The InChIKey is UYOTVTJAPKKPNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20O/c17-16(13-6-2-3-7-13)15-10-9-12-5-1-4-8-14(12)11-15/h1,4-5,8,13,15H,2-3,6-7,9-11H2.
What are the key properties of cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone?
cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone has a molecular weight of 228.34 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl(1,2,3,4-tetrahydronaphthalen-2-yl)methanone is sourced from PubChem (CID 65409165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).