1-ethenylpyrrolidine;pyrrolidin-2-one

C10H18N2O — CID 174946746

IUPAC1-ethenylpyrrolidine;pyrrolidin-2-one
SMILESC=CN1CCCC1.O=C1CCCN1
InChIInChI=1S/C6H11N.C4H7NO/c1-2-7-5-3-4-6-7;6-4-2-1-3-5-4/h2H,1,3-6H2;1-3H2,(H,5,6)
InChIKeyHQNLQJRDWPDHQN-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.12
Rot. Bonds1

About 1-ethenylpyrrolidine;pyrrolidin-2-one

1-ethenylpyrrolidine;pyrrolidin-2-one (PubChem CID 174946746) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 1-ethenylpyrrolidine;pyrrolidin-2-one.

Molecular Properties

Compound Name1-ethenylpyrrolidine;pyrrolidin-2-one
PubChem CID174946746
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name1-ethenylpyrrolidine;pyrrolidin-2-one
SMILESC=CN1CCCC1.O=C1CCCN1
InChIInChI=1S/C6H11N.C4H7NO/c1-2-7-5-3-4-6-7;6-4-2-1-3-5-4/h2H,1,3-6H2;1-3H2,(H,5,6)
InChIKeyHQNLQJRDWPDHQN-UHFFFAOYSA-N
XLogP1.12
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethenylpyrrolidine;pyrrolidin-2-one?
The IUPAC name of 1-ethenylpyrrolidine;pyrrolidin-2-one (CID 174946746) is 1-ethenylpyrrolidine;pyrrolidin-2-one.
What is the SMILES notation for 1-ethenylpyrrolidine;pyrrolidin-2-one?
The canonical SMILES for 1-ethenylpyrrolidine;pyrrolidin-2-one is C=CN1CCCC1.O=C1CCCN1.
What is the InChIKey of 1-ethenylpyrrolidine;pyrrolidin-2-one?
The InChIKey is HQNLQJRDWPDHQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N.C4H7NO/c1-2-7-5-3-4-6-7;6-4-2-1-3-5-4/h2H,1,3-6H2;1-3H2,(H,5,6).
What are the key properties of 1-ethenylpyrrolidine;pyrrolidin-2-one?
1-ethenylpyrrolidine;pyrrolidin-2-one has a molecular weight of 182.27 g/mol, XLogP of 1.12, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenylpyrrolidine;pyrrolidin-2-one is sourced from PubChem (CID 174946746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).