N-prop-2-enylmorpholine-4-carboxamide

C8H14N2O2 — CID 50901837

IUPACN-prop-2-enylmorpholine-4-carboxamide
SMILESC=CCNC(=O)N1CCOCC1
InChIInChI=1S/C8H14N2O2/c1-2-3-9-8(11)10-4-6-12-7-5-10/h2H,1,3-7H2,(H,9,11)
InChIKeyQJSZQFKOSABBSN-UHFFFAOYSA-N
MW170.21 g/mol
LogP0.21
Rot. Bonds2

About N-prop-2-enylmorpholine-4-carboxamide

N-prop-2-enylmorpholine-4-carboxamide (PubChem CID 50901837) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is N-prop-2-enylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-prop-2-enylmorpholine-4-carboxamide
PubChem CID50901837
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC NameN-prop-2-enylmorpholine-4-carboxamide
SMILESC=CCNC(=O)N1CCOCC1
InChIInChI=1S/C8H14N2O2/c1-2-3-9-8(11)10-4-6-12-7-5-10/h2H,1,3-7H2,(H,9,11)
InChIKeyQJSZQFKOSABBSN-UHFFFAOYSA-N
XLogP0.21
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 N-prop-2-enylmorpholine-4-carboxamide?
The IUPAC name of N-prop-2-enylmorpholine-4-carboxamide (CID 50901837) is N-prop-2-enylmorpholine-4-carboxamide.
What is the SMILES notation for N-prop-2-enylmorpholine-4-carboxamide?
The canonical SMILES for N-prop-2-enylmorpholine-4-carboxamide is C=CCNC(=O)N1CCOCC1.
What is the InChIKey of N-prop-2-enylmorpholine-4-carboxamide?
The InChIKey is QJSZQFKOSABBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-2-3-9-8(11)10-4-6-12-7-5-10/h2H,1,3-7H2,(H,9,11).
What are the key properties of N-prop-2-enylmorpholine-4-carboxamide?
N-prop-2-enylmorpholine-4-carboxamide has a molecular weight of 170.21 g/mol, XLogP of 0.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enylmorpholine-4-carboxamide is sourced from PubChem (CID 50901837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).