5-benzyl-1-cyclopropyl-2-methylpiperazine

C15H22N2 — CID 64954279

IUPAC5-benzyl-1-cyclopropyl-2-methylpiperazine
SMILESCC1CNC(Cc2ccccc2)CN1C1CC1
InChIInChI=1S/C15H22N2/c1-12-10-16-14(11-17(12)15-7-8-15)9-13-5-3-2-4-6-13/h2-6,12,14-16H,7-11H2,1H3
InChIKeyBYKMVLWHEHRSNO-UHFFFAOYSA-N
MW230.36 g/mol
LogP2.05
Rot. Bonds3

About 5-benzyl-1-cyclopropyl-2-methylpiperazine

5-benzyl-1-cyclopropyl-2-methylpiperazine (PubChem CID 64954279) has the molecular formula C15H22N2 and a molecular weight of 230.36 g/mol. Its IUPAC name is 5-benzyl-1-cyclopropyl-2-methylpiperazine.

Molecular Properties

Compound Name5-benzyl-1-cyclopropyl-2-methylpiperazine
PubChem CID64954279
Molecular FormulaC15H22N2
Molecular Weight230.36 g/mol
Exact Mass230.18
IUPAC Name5-benzyl-1-cyclopropyl-2-methylpiperazine
SMILESCC1CNC(Cc2ccccc2)CN1C1CC1
InChIInChI=1S/C15H22N2/c1-12-10-16-14(11-17(12)15-7-8-15)9-13-5-3-2-4-6-13/h2-6,12,14-16H,7-11H2,1H3
InChIKeyBYKMVLWHEHRSNO-UHFFFAOYSA-N
XLogP2.05
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.36
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-benzyl-1-cyclopropyl-2-methylpiperazine?
The IUPAC name of 5-benzyl-1-cyclopropyl-2-methylpiperazine (CID 64954279) is 5-benzyl-1-cyclopropyl-2-methylpiperazine.
What is the SMILES notation for 5-benzyl-1-cyclopropyl-2-methylpiperazine?
The canonical SMILES for 5-benzyl-1-cyclopropyl-2-methylpiperazine is CC1CNC(Cc2ccccc2)CN1C1CC1.
What is the InChIKey of 5-benzyl-1-cyclopropyl-2-methylpiperazine?
The InChIKey is BYKMVLWHEHRSNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-12-10-16-14(11-17(12)15-7-8-15)9-13-5-3-2-4-6-13/h2-6,12,14-16H,7-11H2,1H3.
What are the key properties of 5-benzyl-1-cyclopropyl-2-methylpiperazine?
5-benzyl-1-cyclopropyl-2-methylpiperazine has a molecular weight of 230.36 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-1-cyclopropyl-2-methylpiperazine is sourced from PubChem (CID 64954279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).