formic acid;morpholine

C5H11NO3 — CID 13094120

IUPACformic acid;morpholine
SMILESC1COCCN1.O=CO
InChIInChI=1S/C4H9NO.CH2O2/c1-3-6-4-2-5-1;2-1-3/h5H,1-4H2;1H,(H,2,3)
InChIKeyBDHPJXPOQGPUNI-UHFFFAOYSA-N
MW133.15 g/mol
LogP-0.69
Rot. Bonds

About formic acid;morpholine

formic acid;morpholine (PubChem CID 13094120) has the molecular formula C5H11NO3 and a molecular weight of 133.15 g/mol. Its IUPAC name is formic acid;morpholine.

Molecular Properties

Compound Nameformic acid;morpholine
PubChem CID13094120
Molecular FormulaC5H11NO3
Molecular Weight133.15 g/mol
Exact Mass133.07
IUPAC Nameformic acid;morpholine
SMILESC1COCCN1.O=CO
InChIInChI=1S/C4H9NO.CH2O2/c1-3-6-4-2-5-1;2-1-3/h5H,1-4H2;1H,(H,2,3)
InChIKeyBDHPJXPOQGPUNI-UHFFFAOYSA-N
XLogP-0.69
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 5-0.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

benzene;formic acid;morpholine
CID 158324821
morpholine;nitroxyl
CID 160677899
morpholine;ruthenium(3+)
CID 162097690
sodium morpholine
CID 21469219
morpholine;piperazine
CID 22665942
CID 87713044
CID 87713044
1,4,7-trioxa-10-azacyclododecane
CID 545817
morpholine;sulfane
CID 70348588
hydroxy(trioxo)rhenium;morpholine
CID 174851241
ethane;morpholine
CID 91516807
1,4,7,10-tetraoxa-13,16,19-triazacyclohenicosane
CID 10063702
1,4,7,10-tetraoxa-13,16-diazacyclooctadecane
CID 10706622

Frequently Asked Questions

What is the IUPAC name of formic acid;morpholine?
The IUPAC name of formic acid;morpholine (CID 13094120) is formic acid;morpholine.
What is the SMILES notation for formic acid;morpholine?
The canonical SMILES for formic acid;morpholine is C1COCCN1.O=CO.
What is the InChIKey of formic acid;morpholine?
The InChIKey is BDHPJXPOQGPUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.CH2O2/c1-3-6-4-2-5-1;2-1-3/h5H,1-4H2;1H,(H,2,3).
What are the key properties of formic acid;morpholine?
formic acid;morpholine has a molecular weight of 133.15 g/mol, XLogP of -0.69, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for formic acid;morpholine is sourced from PubChem (CID 13094120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).