cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone

C19H23NO2 — CID 156563786

IUPACcyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone
SMILESCNCCOc1ccc(C(=O)C2CCCC2)c2ccccc12
InChIInChI=1S/C19H23NO2/c1-20-12-13-22-18-11-10-17(15-8-4-5-9-16(15)18)19(21)14-6-2-3-7-14/h4-5,8-11,14,20H,2-3,6-7,12-13H2,1H3
InChIKeyDIAZBZLEEVOJRQ-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.81
Rot. Bonds6

About cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone

cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone (PubChem CID 156563786) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone
PubChem CID156563786
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Namecyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone
SMILESCNCCOc1ccc(C(=O)C2CCCC2)c2ccccc12
InChIInChI=1S/C19H23NO2/c1-20-12-13-22-18-11-10-17(15-8-4-5-9-16(15)18)19(21)14-6-2-3-7-14/h4-5,8-11,14,20H,2-3,6-7,12-13H2,1H3
InChIKeyDIAZBZLEEVOJRQ-UHFFFAOYSA-N
XLogP3.81
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

cyclohexyl-(2-propoxynaphthalen-1-yl)methanone
CID 82550350
N-methyl-3-naphthalen-1-yloxypropan-1-amine;oxalic acid
CID 2949357
(4-bromonaphthalen-1-yl)-cyclobutylmethanone
CID 79596781
cyclopropyl-(2,3-dimethyl-4-propoxyphenyl)methanone
CID 82266397
cyclopentyl-[2-(methoxymethoxy)phenyl]methanone
CID 10082767
(4-methoxynaphthalen-1-yl)-(9-thiabicyclo[3.3.1]nonan-3-yl)methanone
CID 171943186
(8-butoxyquinolin-5-yl)-piperidin-4-ylmethanone
CID 96709887
N-[2-[4-[(1E,6E)-7-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]-3,5-dioxohepta-1,6-dienyl]naphthalen-1-yl]oxyethyl]formamide
CID 126636013
cyclopentyl-(2-methoxy-3,4-dimethylphenyl)methanone
CID 103432869
8-azabicyclo[3.2.1]octan-3-yl-(4-methoxynaphthalen-1-yl)methanone
CID 171943170
cyclooctyl-(2-methoxyphenyl)methanone
CID 80602820
cyclohexyl(1,2-dihydroacenaphthylen-5-yl)methanone
CID 82646222

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone?
The IUPAC name of cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone (CID 156563786) is cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone.
What is the SMILES notation for cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone?
The canonical SMILES for cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone is CNCCOc1ccc(C(=O)C2CCCC2)c2ccccc12.
What is the InChIKey of cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone?
The InChIKey is DIAZBZLEEVOJRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-20-12-13-22-18-11-10-17(15-8-4-5-9-16(15)18)19(21)14-6-2-3-7-14/h4-5,8-11,14,20H,2-3,6-7,12-13H2,1H3.
What are the key properties of cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone?
cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone has a molecular weight of 297.40 g/mol, XLogP of 3.81, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[4-[2-(methylamino)ethoxy]naphthalen-1-yl]methanone is sourced from PubChem (CID 156563786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).