1-prop-1-enylpiperazin-2-one

C7H12N2O — CID 141488928

IUPAC1-prop-1-enylpiperazin-2-one
SMILESCC=CN1CCNCC1=O
InChIInChI=1S/C7H12N2O/c1-2-4-9-5-3-8-6-7(9)10/h2,4,8H,3,5-6H2,1H3
InChIKeyOIJZMPGGTLNOGW-UHFFFAOYSA-N
MW140.19 g/mol
LogP-0.05
Rot. Bonds1

About 1-prop-1-enylpiperazin-2-one

1-prop-1-enylpiperazin-2-one (PubChem CID 141488928) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 1-prop-1-enylpiperazin-2-one.

Molecular Properties

Compound Name1-prop-1-enylpiperazin-2-one
PubChem CID141488928
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name1-prop-1-enylpiperazin-2-one
SMILESCC=CN1CCNCC1=O
InChIInChI=1S/C7H12N2O/c1-2-4-9-5-3-8-6-7(9)10/h2,4,8H,3,5-6H2,1H3
InChIKeyOIJZMPGGTLNOGW-UHFFFAOYSA-N
XLogP-0.05
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-prop-1-enylpiperazin-2-one?
The IUPAC name of 1-prop-1-enylpiperazin-2-one (CID 141488928) is 1-prop-1-enylpiperazin-2-one.
What is the SMILES notation for 1-prop-1-enylpiperazin-2-one?
The canonical SMILES for 1-prop-1-enylpiperazin-2-one is CC=CN1CCNCC1=O.
What is the InChIKey of 1-prop-1-enylpiperazin-2-one?
The InChIKey is OIJZMPGGTLNOGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-2-4-9-5-3-8-6-7(9)10/h2,4,8H,3,5-6H2,1H3.
What are the key properties of 1-prop-1-enylpiperazin-2-one?
1-prop-1-enylpiperazin-2-one has a molecular weight of 140.19 g/mol, XLogP of -0.05, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-prop-1-enylpiperazin-2-one is sourced from PubChem (CID 141488928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).