morpholine;prop-2-en-1-amine

C7H16N2O — CID 90405942

IUPACmorpholine;prop-2-en-1-amine
SMILESC1COCCN1.C=CCN
InChIInChI=1S/C4H9NO.C3H7N/c1-3-6-4-2-5-1;1-2-3-4/h5H,1-4H2;2H,1,3-4H2
InChIKeyNUEHDIXMJSJAPZ-UHFFFAOYSA-N
MW144.22 g/mol
LogP-0.26
Rot. Bonds1

About morpholine;prop-2-en-1-amine

morpholine;prop-2-en-1-amine (PubChem CID 90405942) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is morpholine;prop-2-en-1-amine.

Molecular Properties

Compound Namemorpholine;prop-2-en-1-amine
PubChem CID90405942
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Namemorpholine;prop-2-en-1-amine
SMILESC1COCCN1.C=CCN
InChIInChI=1S/C4H9NO.C3H7N/c1-3-6-4-2-5-1;1-2-3-4/h5H,1-4H2;2H,1,3-4H2
InChIKeyNUEHDIXMJSJAPZ-UHFFFAOYSA-N
XLogP-0.26
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of morpholine;prop-2-en-1-amine?
The IUPAC name of morpholine;prop-2-en-1-amine (CID 90405942) is morpholine;prop-2-en-1-amine.
What is the SMILES notation for morpholine;prop-2-en-1-amine?
The canonical SMILES for morpholine;prop-2-en-1-amine is C1COCCN1.C=CCN.
What is the InChIKey of morpholine;prop-2-en-1-amine?
The InChIKey is NUEHDIXMJSJAPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.C3H7N/c1-3-6-4-2-5-1;1-2-3-4/h5H,1-4H2;2H,1,3-4H2.
What are the key properties of morpholine;prop-2-en-1-amine?
morpholine;prop-2-en-1-amine has a molecular weight of 144.22 g/mol, XLogP of -0.26, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for morpholine;prop-2-en-1-amine is sourced from PubChem (CID 90405942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).