oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone

C15H18O2 — CID 61272773

IUPACoxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone
SMILESO=C(c1ccc2c(c1)CCCC2)C1CCOC1
InChIInChI=1S/C15H18O2/c16-15(14-7-8-17-10-14)13-6-5-11-3-1-2-4-12(11)9-13/h5-6,9,14H,1-4,7-8,10H2
InChIKeyYISRVEWDKVGFQL-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.78
Rot. Bonds2

About oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone

oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone (PubChem CID 61272773) has the molecular formula C15H18O2 and a molecular weight of 230.31 g/mol. Its IUPAC name is oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone.

Molecular Properties

Compound Nameoxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone
PubChem CID61272773
Molecular FormulaC15H18O2
Molecular Weight230.31 g/mol
Exact Mass230.13
IUPAC Nameoxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone
SMILESO=C(c1ccc2c(c1)CCCC2)C1CCOC1
InChIInChI=1S/C15H18O2/c16-15(14-7-8-17-10-14)13-6-5-11-3-1-2-4-12(11)9-13/h5-6,9,14H,1-4,7-8,10H2
InChIKeyYISRVEWDKVGFQL-UHFFFAOYSA-N
XLogP2.78
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dihydro-1H-indol-5-yl(oxolan-3-yl)methanone
CID 116554107
oxolan-3-yl-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)methanone
CID 116525791
(4-chloro-3-methylphenyl)-(oxolan-3-yl)methanone
CID 114972047
(3-iodophenyl)-(oxolan-3-yl)methanone
CID 114972035
5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 25958
(3-amino-5-bromophenyl)-(oxolan-3-yl)methanone
CID 116597079
6-(oxolane-3-carbonyl)-3H-1,3-benzoxazol-2-one
CID 61273175
2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;cyclopropanecarboxamide;5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 143860761
2-morpholin-3-yl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
CID 116919885
(3-fluoro-4-methylphenyl)-(oxan-3-yl)methanone
CID 107128324
N-(2-cyanoethyl)-N-(oxan-4-yl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 56784305
6-(oxolane-3-carbonyl)-4H-1,4-benzoxazin-3-one
CID 61273172

Frequently Asked Questions

What is the IUPAC name of oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone?
The IUPAC name of oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone (CID 61272773) is oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone.
What is the SMILES notation for oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone?
The canonical SMILES for oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone is O=C(c1ccc2c(c1)CCCC2)C1CCOC1.
What is the InChIKey of oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone?
The InChIKey is YISRVEWDKVGFQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O2/c16-15(14-7-8-17-10-14)13-6-5-11-3-1-2-4-12(11)9-13/h5-6,9,14H,1-4,7-8,10H2.
What are the key properties of oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone?
oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone has a molecular weight of 230.31 g/mol, XLogP of 2.78, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone is sourced from PubChem (CID 61272773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).