cyclopropyl(piperazin-1-yl)methanone

C8H14N2O — CID 2064235

IUPACcyclopropyl(piperazin-1-yl)methanone
SMILESO=C(C1CC1)N1CCNCC1
InChIInChI=1S/C8H14N2O/c11-8(7-1-2-7)10-5-3-9-4-6-10/h7,9H,1-6H2
InChIKeyKIALFUYSJAAJSU-UHFFFAOYSA-N
MW154.21 g/mol
LogP-0.17
Rot. Bonds1

About cyclopropyl(piperazin-1-yl)methanone

cyclopropyl(piperazin-1-yl)methanone (PubChem CID 2064235) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is cyclopropyl(piperazin-1-yl)methanone.

Molecular Properties

Compound Namecyclopropyl(piperazin-1-yl)methanone
PubChem CID2064235
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Namecyclopropyl(piperazin-1-yl)methanone
SMILESO=C(C1CC1)N1CCNCC1
InChIInChI=1S/C8H14N2O/c11-8(7-1-2-7)10-5-3-9-4-6-10/h7,9H,1-6H2
InChIKeyKIALFUYSJAAJSU-UHFFFAOYSA-N
XLogP-0.17
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl(piperazin-1-yl)methanone?
The IUPAC name of cyclopropyl(piperazin-1-yl)methanone (CID 2064235) is cyclopropyl(piperazin-1-yl)methanone.
What is the SMILES notation for cyclopropyl(piperazin-1-yl)methanone?
The canonical SMILES for cyclopropyl(piperazin-1-yl)methanone is O=C(C1CC1)N1CCNCC1.
What is the InChIKey of cyclopropyl(piperazin-1-yl)methanone?
The InChIKey is KIALFUYSJAAJSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c11-8(7-1-2-7)10-5-3-9-4-6-10/h7,9H,1-6H2.
What are the key properties of cyclopropyl(piperazin-1-yl)methanone?
cyclopropyl(piperazin-1-yl)methanone has a molecular weight of 154.21 g/mol, XLogP of -0.17, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl(piperazin-1-yl)methanone is sourced from PubChem (CID 2064235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).