morpholine;hydrate

C4H11NO2 — CID 67723360

IUPACmorpholine;hydrate
SMILESC1COCCN1.O
InChIInChI=1S/C4H9NO.H2O/c1-3-6-4-2-5-1;/h5H,1-4H2;1H2
InChIKeyFWCHISPFSGCORQ-UHFFFAOYSA-N
MW105.14 g/mol
LogP-1.22
Rot. Bonds

About morpholine;hydrate

morpholine;hydrate (PubChem CID 67723360) has the molecular formula C4H11NO2 and a molecular weight of 105.14 g/mol. Its IUPAC name is morpholine;hydrate.

Molecular Properties

Compound Namemorpholine;hydrate
PubChem CID67723360
Molecular FormulaC4H11NO2
Molecular Weight105.14 g/mol
Exact Mass105.08
IUPAC Namemorpholine;hydrate
SMILESC1COCCN1.O
InChIInChI=1S/C4H9NO.H2O/c1-3-6-4-2-5-1;/h5H,1-4H2;1H2
InChIKeyFWCHISPFSGCORQ-UHFFFAOYSA-N
XLogP-1.22
TPSA52.76 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.14
LogP ≤ 5-1.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of morpholine;hydrate?
The IUPAC name of morpholine;hydrate (CID 67723360) is morpholine;hydrate.
What is the SMILES notation for morpholine;hydrate?
The canonical SMILES for morpholine;hydrate is C1COCCN1.O.
What is the InChIKey of morpholine;hydrate?
The InChIKey is FWCHISPFSGCORQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.H2O/c1-3-6-4-2-5-1;/h5H,1-4H2;1H2.
What are the key properties of morpholine;hydrate?
morpholine;hydrate has a molecular weight of 105.14 g/mol, XLogP of -1.22, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for morpholine;hydrate is sourced from PubChem (CID 67723360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).