(6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one

C12H16O2 — CID 102033083

IUPAC(6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one
SMILESO=C1C=CCC[C@@H]1[C@H]1CCCCC1=O
InChIInChI=1S/C12H16O2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h3,7,9-10H,1-2,4-6,8H2/t9-,10-/m1/s1
InChIKeyLVOPJGQCDHWCHT-NXEZZACHSA-N
MW192.26 g/mol
LogP2.28
Rot. Bonds1

About (6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one

(6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one (PubChem CID 102033083) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is (6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one.

Molecular Properties

Compound Name(6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one
PubChem CID102033083
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name(6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one
SMILESO=C1C=CCC[C@@H]1[C@H]1CCCCC1=O
InChIInChI=1S/C12H16O2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h3,7,9-10H,1-2,4-6,8H2/t9-,10-/m1/s1
InChIKeyLVOPJGQCDHWCHT-NXEZZACHSA-N
XLogP2.28
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one?
The IUPAC name of (6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one (CID 102033083) is (6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one.
What is the SMILES notation for (6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one?
The canonical SMILES for (6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one is O=C1C=CCC[C@@H]1[C@H]1CCCCC1=O.
What is the InChIKey of (6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one?
The InChIKey is LVOPJGQCDHWCHT-NXEZZACHSA-N. The full InChI is InChI=1S/C12H16O2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h3,7,9-10H,1-2,4-6,8H2/t9-,10-/m1/s1.
What are the key properties of (6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one?
(6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one has a molecular weight of 192.26 g/mol, XLogP of 2.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-[(1R)-2-oxocyclohexyl]cyclohex-2-en-1-one is sourced from PubChem (CID 102033083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).