1-cyclopropyl-4-propan-2-ylpiperazin-2-one

C10H18N2O — CID 134166310

IUPAC1-cyclopropyl-4-propan-2-ylpiperazin-2-one
SMILESCC(C)N1CCN(C2CC2)C(=O)C1
InChIInChI=1S/C10H18N2O/c1-8(2)11-5-6-12(9-3-4-9)10(13)7-11/h8-9H,3-7H2,1-2H3
InChIKeyCOAYVZFNJXZNHI-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.70
Rot. Bonds2

About 1-cyclopropyl-4-propan-2-ylpiperazin-2-one

1-cyclopropyl-4-propan-2-ylpiperazin-2-one (PubChem CID 134166310) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 1-cyclopropyl-4-propan-2-ylpiperazin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-4-propan-2-ylpiperazin-2-one
PubChem CID134166310
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name1-cyclopropyl-4-propan-2-ylpiperazin-2-one
SMILESCC(C)N1CCN(C2CC2)C(=O)C1
InChIInChI=1S/C10H18N2O/c1-8(2)11-5-6-12(9-3-4-9)10(13)7-11/h8-9H,3-7H2,1-2H3
InChIKeyCOAYVZFNJXZNHI-UHFFFAOYSA-N
XLogP0.70
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-propan-2-ylpiperazin-2-one?
The IUPAC name of 1-cyclopropyl-4-propan-2-ylpiperazin-2-one (CID 134166310) is 1-cyclopropyl-4-propan-2-ylpiperazin-2-one.
What is the SMILES notation for 1-cyclopropyl-4-propan-2-ylpiperazin-2-one?
The canonical SMILES for 1-cyclopropyl-4-propan-2-ylpiperazin-2-one is CC(C)N1CCN(C2CC2)C(=O)C1.
What is the InChIKey of 1-cyclopropyl-4-propan-2-ylpiperazin-2-one?
The InChIKey is COAYVZFNJXZNHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-8(2)11-5-6-12(9-3-4-9)10(13)7-11/h8-9H,3-7H2,1-2H3.
What are the key properties of 1-cyclopropyl-4-propan-2-ylpiperazin-2-one?
1-cyclopropyl-4-propan-2-ylpiperazin-2-one has a molecular weight of 182.27 g/mol, XLogP of 0.70, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4-propan-2-ylpiperazin-2-one is sourced from PubChem (CID 134166310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).