3-(furan-2-yl)-4-methylmorpholin-2-one

C9H11NO3 — CID 15134388

IUPAC3-(furan-2-yl)-4-methylmorpholin-2-one
SMILESCN1CCOC(=O)C1c1ccco1
InChIInChI=1S/C9H11NO3/c1-10-4-6-13-9(11)8(10)7-3-2-5-12-7/h2-3,5,8H,4,6H2,1H3
InChIKeyDOJLTFYJJOJVAF-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.81
Rot. Bonds1

About 3-(furan-2-yl)-4-methylmorpholin-2-one

3-(furan-2-yl)-4-methylmorpholin-2-one (PubChem CID 15134388) has the molecular formula C9H11NO3 and a molecular weight of 181.19 g/mol. Its IUPAC name is 3-(furan-2-yl)-4-methylmorpholin-2-one.

Molecular Properties

Compound Name3-(furan-2-yl)-4-methylmorpholin-2-one
PubChem CID15134388
Molecular FormulaC9H11NO3
Molecular Weight181.19 g/mol
Exact Mass181.07
IUPAC Name3-(furan-2-yl)-4-methylmorpholin-2-one
SMILESCN1CCOC(=O)C1c1ccco1
InChIInChI=1S/C9H11NO3/c1-10-4-6-13-9(11)8(10)7-3-2-5-12-7/h2-3,5,8H,4,6H2,1H3
InChIKeyDOJLTFYJJOJVAF-UHFFFAOYSA-N
XLogP0.81
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(furan-2-yl)-1-methylpyrrolidin-3-one
CID 83826796
1-(furan-2-yl)-2-methyl-3,4-dihydro-1H-isoquinoline
CID 15056816
(2S)-2-(furan-2-yl)-1-methylpyrrolidine
CID 24894514
2-(4,7-dimethyl-3a,5,6,7a-tetrahydro-[1,3]dithiolo[4,5-b]pyrazin-2-ylidene)-5-(furan-2-yl)cyclohexane-1,3-dione
CID 14516895
(2R,6S,7S,9R,13S,14S)-7,14-bis(furan-2-yl)-4,11-dimethyl-1,4,8,11-tetrazatetracyclo[6.6.0.02,6.09,13]tetradecane-3,5,10,12-tetrone
CID 124724599
(2R)-2-(furan-2-yl)-3-[2-[(2S)-2-(furan-2-yl)-4-oxo-1,3-thiazolidin-3-yl]ethyl]-1,3-thiazolidin-4-one
CID 92530307
(1R)-1-(furan-2-yl)-2-(2-morpholin-4-ylethyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
CID 2037117
(4Z)-5-(furan-2-yl)-1-(furan-2-ylmethyl)-4-[hydroxy-(4-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)methylidene]pyrrolidine-2,3-dione
CID 108656012
3-ethyl-2-(furan-2-yl)-1,3-thiazolidin-4-one
CID 3800198
N-methyl-2-(4-methyl-2-oxomorpholin-3-yl)-N-phenylacetamide
CID 143922749
(4Z)-1-[4-(dimethylamino)phenyl]-5-(furan-2-yl)-4-[hydroxy-(4-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)methylidene]pyrrolidine-2,3-dione
CID 108652810
(4R)-4-(furan-2-yl)pyrrolidin-2-one
CID 94826830

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-4-methylmorpholin-2-one?
The IUPAC name of 3-(furan-2-yl)-4-methylmorpholin-2-one (CID 15134388) is 3-(furan-2-yl)-4-methylmorpholin-2-one.
What is the SMILES notation for 3-(furan-2-yl)-4-methylmorpholin-2-one?
The canonical SMILES for 3-(furan-2-yl)-4-methylmorpholin-2-one is CN1CCOC(=O)C1c1ccco1.
What is the InChIKey of 3-(furan-2-yl)-4-methylmorpholin-2-one?
The InChIKey is DOJLTFYJJOJVAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO3/c1-10-4-6-13-9(11)8(10)7-3-2-5-12-7/h2-3,5,8H,4,6H2,1H3.
What are the key properties of 3-(furan-2-yl)-4-methylmorpholin-2-one?
3-(furan-2-yl)-4-methylmorpholin-2-one has a molecular weight of 181.19 g/mol, XLogP of 0.81, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-4-methylmorpholin-2-one is sourced from PubChem (CID 15134388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).