N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide

C11H19N3O2 — CID 107433788

IUPACN-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide
SMILESCCCN(C(=O)C1CNC(=O)CN1)C1CC1
InChIInChI=1S/C11H19N3O2/c1-2-5-14(8-3-4-8)11(16)9-6-13-10(15)7-12-9/h8-9,12H,2-7H2,1H3,(H,13,15)
InChIKeyOODHJXLQHQQCKT-UHFFFAOYSA-N
MW225.29 g/mol
LogP-0.52
Rot. Bonds4

About N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide

N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide (PubChem CID 107433788) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide
PubChem CID107433788
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC NameN-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide
SMILESCCCN(C(=O)C1CNC(=O)CN1)C1CC1
InChIInChI=1S/C11H19N3O2/c1-2-5-14(8-3-4-8)11(16)9-6-13-10(15)7-12-9/h8-9,12H,2-7H2,1H3,(H,13,15)
InChIKeyOODHJXLQHQQCKT-UHFFFAOYSA-N
XLogP-0.52
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 5-0.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide?
The IUPAC name of N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide (CID 107433788) is N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide is CCCN(C(=O)C1CNC(=O)CN1)C1CC1.
What is the InChIKey of N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide?
The InChIKey is OODHJXLQHQQCKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-2-5-14(8-3-4-8)11(16)9-6-13-10(15)7-12-9/h8-9,12H,2-7H2,1H3,(H,13,15).
What are the key properties of N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide?
N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide has a molecular weight of 225.29 g/mol, XLogP of -0.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-oxo-N-propylpiperazine-2-carboxamide is sourced from PubChem (CID 107433788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).