2-piperazin-1-ylethanamine;pyrrolidin-2-one

C10H22N4O — CID 174882748

IUPAC2-piperazin-1-ylethanamine;pyrrolidin-2-one
SMILESNCCN1CCNCC1.O=C1CCCN1
InChIInChI=1S/C6H15N3.C4H7NO/c7-1-4-9-5-2-8-3-6-9;6-4-2-1-3-5-4/h8H,1-7H2;1-3H2,(H,5,6)
InChIKeyOHZGTNUTMBBXDC-UHFFFAOYSA-N
MW214.31 g/mol
LogP-1.25
Rot. Bonds2

About 2-piperazin-1-ylethanamine;pyrrolidin-2-one

2-piperazin-1-ylethanamine;pyrrolidin-2-one (PubChem CID 174882748) has the molecular formula C10H22N4O and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-piperazin-1-ylethanamine;pyrrolidin-2-one.

Molecular Properties

Compound Name2-piperazin-1-ylethanamine;pyrrolidin-2-one
PubChem CID174882748
Molecular FormulaC10H22N4O
Molecular Weight214.31 g/mol
Exact Mass214.18
IUPAC Name2-piperazin-1-ylethanamine;pyrrolidin-2-one
SMILESNCCN1CCNCC1.O=C1CCCN1
InChIInChI=1S/C6H15N3.C4H7NO/c7-1-4-9-5-2-8-3-6-9;6-4-2-1-3-5-4/h8H,1-7H2;1-3H2,(H,5,6)
InChIKeyOHZGTNUTMBBXDC-UHFFFAOYSA-N
XLogP-1.25
TPSA70.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 5-1.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-piperazin-1-ylethanol;piperidin-2-one
CID 159123394
methane;2-piperazin-1-ylethanamine
CID 160655027
2-[4-[2-[4-(2-piperazin-1-ylethyl)piperazin-1-yl]ethyl]piperazin-1-yl]ethanamine
CID 130322012
ethanamine;pyrrolidin-2-one
CID 175437150
1-propyl-1,4-diazocan-5-one
CID 117015407
arsane;pyrrolidin-2-one
CID 174413202
astatane;pyrrolidin-2-one
CID 174831438
pyrrolidin-2-one;hydrate
CID 19382566
ethene;pyrrolidin-2-one
CID 18949514
magnesium;pyrrolidin-2-one;dibromide
CID 67853208
ethene;bis(pyrrolidin-2-one)
CID 67822125
ethane;pyrrolidin-2-one
CID 54451151

Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-ylethanamine;pyrrolidin-2-one?
The IUPAC name of 2-piperazin-1-ylethanamine;pyrrolidin-2-one (CID 174882748) is 2-piperazin-1-ylethanamine;pyrrolidin-2-one.
What is the SMILES notation for 2-piperazin-1-ylethanamine;pyrrolidin-2-one?
The canonical SMILES for 2-piperazin-1-ylethanamine;pyrrolidin-2-one is NCCN1CCNCC1.O=C1CCCN1.
What is the InChIKey of 2-piperazin-1-ylethanamine;pyrrolidin-2-one?
The InChIKey is OHZGTNUTMBBXDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3.C4H7NO/c7-1-4-9-5-2-8-3-6-9;6-4-2-1-3-5-4/h8H,1-7H2;1-3H2,(H,5,6).
What are the key properties of 2-piperazin-1-ylethanamine;pyrrolidin-2-one?
2-piperazin-1-ylethanamine;pyrrolidin-2-one has a molecular weight of 214.31 g/mol, XLogP of -1.25, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-ylethanamine;pyrrolidin-2-one is sourced from PubChem (CID 174882748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).