2-methylpent-2-enamide;morpholine

C10H20N2O2 — CID 66895956

IUPAC2-methylpent-2-enamide;morpholine
SMILESC1COCCN1.CCC=C(C)C(N)=O
InChIInChI=1S/C6H11NO.C4H9NO/c1-3-4-5(2)6(7)8;1-3-6-4-2-5-1/h4H,3H2,1-2H3,(H2,7,8);5H,1-4H2
InChIKeySHZWJAQAUDVROT-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.43
Rot. Bonds2

About 2-methylpent-2-enamide;morpholine

2-methylpent-2-enamide;morpholine (PubChem CID 66895956) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-methylpent-2-enamide;morpholine.

Molecular Properties

Compound Name2-methylpent-2-enamide;morpholine
PubChem CID66895956
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-methylpent-2-enamide;morpholine
SMILESC1COCCN1.CCC=C(C)C(N)=O
InChIInChI=1S/C6H11NO.C4H9NO/c1-3-4-5(2)6(7)8;1-3-6-4-2-5-1/h4H,3H2,1-2H3,(H2,7,8);5H,1-4H2
InChIKeySHZWJAQAUDVROT-UHFFFAOYSA-N
XLogP0.43
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methylpent-2-enamide;morpholine?
The IUPAC name of 2-methylpent-2-enamide;morpholine (CID 66895956) is 2-methylpent-2-enamide;morpholine.
What is the SMILES notation for 2-methylpent-2-enamide;morpholine?
The canonical SMILES for 2-methylpent-2-enamide;morpholine is C1COCCN1.CCC=C(C)C(N)=O.
What is the InChIKey of 2-methylpent-2-enamide;morpholine?
The InChIKey is SHZWJAQAUDVROT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO.C4H9NO/c1-3-4-5(2)6(7)8;1-3-6-4-2-5-1/h4H,3H2,1-2H3,(H2,7,8);5H,1-4H2.
What are the key properties of 2-methylpent-2-enamide;morpholine?
2-methylpent-2-enamide;morpholine has a molecular weight of 200.28 g/mol, XLogP of 0.43, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpent-2-enamide;morpholine is sourced from PubChem (CID 66895956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).