[(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone

C10H17NO3 — CID 130180210

IUPAC[(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone
SMILESC[C@H]1COCCN1C(=O)C1CCOC1
InChIInChI=1S/C10H17NO3/c1-8-6-14-5-3-11(8)10(12)9-2-4-13-7-9/h8-9H,2-7H2,1H3/t8-,9?/m0/s1
InChIKeyLHIJBEBTCZUROS-IENPIDJESA-N
MW199.25 g/mol
LogP0.27
Rot. Bonds1

About [(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone

[(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone (PubChem CID 130180210) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is [(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone.

Molecular Properties

Compound Name[(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone
PubChem CID130180210
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name[(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone
SMILESC[C@H]1COCCN1C(=O)C1CCOC1
InChIInChI=1S/C10H17NO3/c1-8-6-14-5-3-11(8)10(12)9-2-4-13-7-9/h8-9H,2-7H2,1H3/t8-,9?/m0/s1
InChIKeyLHIJBEBTCZUROS-IENPIDJESA-N
XLogP0.27
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[(3S)-3-methylmorpholin-4-yl]-(oxan-4-yl)methanone
CID 95614757
[(1S,3R)-3-[(3R)-3-methylmorpholine-4-carbonyl]cyclohexyl]-[(3R)-3-methylmorpholin-4-yl]methanone
CID 124866912
7-bicyclo[4.1.0]heptanyl-(3-methylmorpholin-4-yl)methanone
CID 71925557
(2R,5S)-5-[(3R)-3-methylmorpholine-4-carbonyl]oxolane-2-carboxylic acid
CID 106773953
(3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 61156609
(2-methyl-4-phenylpiperidin-1-yl)-(oxolan-3-yl)methanone
CID 122139809
(4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone
CID 106774354
(3-methylmorpholin-4-yl)-(3-methylpiperidin-2-yl)methanone
CID 62340300
methyl 3-methylmorpholine-4-carboxylate
CID 110292243
3-methyl-1-(3-methylmorpholin-4-yl)but-2-en-1-one
CID 130157030
2-hydroxy-2-methyl-1-(3-methylmorpholin-4-yl)propan-1-one
CID 103429510
[(2S)-2-[(2R)-1-methylpyrrolidin-2-yl]pyrrolidin-1-yl]-[(3R)-oxolan-3-yl]methanone
CID 95294899

Frequently Asked Questions

What is the IUPAC name of [(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone?
The IUPAC name of [(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone (CID 130180210) is [(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone.
What is the SMILES notation for [(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone?
The canonical SMILES for [(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone is C[C@H]1COCCN1C(=O)C1CCOC1.
What is the InChIKey of [(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone?
The InChIKey is LHIJBEBTCZUROS-IENPIDJESA-N. The full InChI is InChI=1S/C10H17NO3/c1-8-6-14-5-3-11(8)10(12)9-2-4-13-7-9/h8-9H,2-7H2,1H3/t8-,9?/m0/s1.
What are the key properties of [(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone?
[(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone has a molecular weight of 199.25 g/mol, XLogP of 0.27, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-3-methylmorpholin-4-yl]-(oxolan-3-yl)methanone is sourced from PubChem (CID 130180210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).