2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one

C11H17NO2 — CID 11127165

IUPAC2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one
SMILESCC1=C(N2CCOCC2)CCCC1=O
InChIInChI=1S/C11H17NO2/c1-9-10(3-2-4-11(9)13)12-5-7-14-8-6-12/h2-8H2,1H3
InChIKeyAWRMQFJTTGZBDW-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.35
Rot. Bonds1

About 2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one

2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one (PubChem CID 11127165) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one.

Molecular Properties

Compound Name2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one
PubChem CID11127165
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one
SMILESCC1=C(N2CCOCC2)CCCC1=O
InChIInChI=1S/C11H17NO2/c1-9-10(3-2-4-11(9)13)12-5-7-14-8-6-12/h2-8H2,1H3
InChIKeyAWRMQFJTTGZBDW-UHFFFAOYSA-N
XLogP1.35
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5,5-Dimethyl-3-morpholino-2-cyclohexen-1-one
CID 725658
3-Morpholin-4-ylcyclohex-2-en-1-one
CID 4373344
3-(2,6-Dimethylmorpholin-4-yl)cyclohex-2-en-1-one
CID 4570259
2-Methyl-3-morpholin-4-ylcyclopent-2-en-1-one
CID 13761641
Cambridge id 5968528
CID 877653
3,5,5-Trimethyl-2-(morpholin-4-yl)cyclohex-2-en-1-one
CID 12388961
2-acetyl-1-(N-morpholinyl)cyclohexene
CID 12366496
2,2,2-Trifluoro-1-(2-morpholin-4-ylcyclopenten-1-yl)ethanone
CID 1954358
2-Acetyl-5,5-dimethyl-3-(4-morpholinyl)-2-cyclohexen-1-one
CID 5345874
3-Methyl-2-(2-morpholin-4-ylethyl)cyclohex-2-en-1-one
CID 5324060
2-morpholin-4-ylcyclohexene-1-carbothioic S-acid
CID 19800625
4,4-Dimethyl-6-methylidene-3-morpholin-4-ylcyclohex-2-en-1-one
CID 57099079

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one?
The IUPAC name of 2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one (CID 11127165) is 2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one.
What is the SMILES notation for 2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one?
The canonical SMILES for 2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one is CC1=C(N2CCOCC2)CCCC1=O.
What is the InChIKey of 2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one?
The InChIKey is AWRMQFJTTGZBDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-9-10(3-2-4-11(9)13)12-5-7-14-8-6-12/h2-8H2,1H3.
What are the key properties of 2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one?
2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one has a molecular weight of 195.26 g/mol, XLogP of 1.35, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-morpholin-4-ylcyclohex-2-en-1-one is sourced from PubChem (CID 11127165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).