1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one

C19H20O2 — CID 61398636

IUPAC1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one
SMILESCC(Oc1ccc2c(c1)CCCC2)C(=O)c1ccccc1
InChIInChI=1S/C19H20O2/c1-14(19(20)16-8-3-2-4-9-16)21-18-12-11-15-7-5-6-10-17(15)13-18/h2-4,8-9,11-14H,5-7,10H2,1H3
InChIKeyKWCHGRMVBYOYRE-UHFFFAOYSA-N
MW280.37 g/mol
LogP4.22
Rot. Bonds4

About 1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one

1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one (PubChem CID 61398636) has the molecular formula C19H20O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one.

Molecular Properties

Compound Name1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one
PubChem CID61398636
Molecular FormulaC19H20O2
Molecular Weight280.37 g/mol
Exact Mass280.15
IUPAC Name1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one
SMILESCC(Oc1ccc2c(c1)CCCC2)C(=O)c1ccccc1
InChIInChI=1S/C19H20O2/c1-14(19(20)16-8-3-2-4-9-16)21-18-12-11-15-7-5-6-10-17(15)13-18/h2-4,8-9,11-14H,5-7,10H2,1H3
InChIKeyKWCHGRMVBYOYRE-UHFFFAOYSA-N
XLogP4.22
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dihydro-1H-inden-5-yloxy)-1-(4-methylphenyl)propan-1-one
CID 43411837
(2R)-2-(4-acetylphenoxy)-1-(2,3-dihydro-1H-inden-5-yl)propan-1-one
CID 7763733
(2S)-N-benzyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 100509467
N-(2-phenoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 133162801
(2R)-2-dibenzofuran-2-yloxy-1-(2,3-dihydro-1H-inden-5-yl)propan-1-one
CID 42554771
(2S)-2-(4-chlorophenoxy)-1-phenylpropan-1-one
CID 94165642
1-phenyl-2-(4-propan-2-ylphenoxy)propan-1-one
CID 43411936
(2S)-N-[(1S)-1-phenylpropyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 100672901
(2R)-N-[(1R)-1-(2-methoxyphenyl)ethyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 100753046
N-(2,4-dimethylpentan-3-yl)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 133185841
(2S)-1-(4-benzhydrylpiperazin-1-yl)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one
CID 100716808
N'-hydroxy-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanimidamide
CID 76914985

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one?
The IUPAC name of 1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one (CID 61398636) is 1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one.
What is the SMILES notation for 1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one?
The canonical SMILES for 1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one is CC(Oc1ccc2c(c1)CCCC2)C(=O)c1ccccc1.
What is the InChIKey of 1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one?
The InChIKey is KWCHGRMVBYOYRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O2/c1-14(19(20)16-8-3-2-4-9-16)21-18-12-11-15-7-5-6-10-17(15)13-18/h2-4,8-9,11-14H,5-7,10H2,1H3.
What are the key properties of 1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one?
1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one has a molecular weight of 280.37 g/mol, XLogP of 4.22, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-one is sourced from PubChem (CID 61398636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).