2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine

C15H30N2 — CID 64942183

IUPAC2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine
SMILESCCCC1CN(CC2(C)CCCC2)C(C)CN1
InChIInChI=1S/C15H30N2/c1-4-7-14-11-17(13(2)10-16-14)12-15(3)8-5-6-9-15/h13-14,16H,4-12H2,1-3H3
InChIKeyYHSSGIGDGCDONY-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.03
Rot. Bonds4

About 2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine

2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine (PubChem CID 64942183) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine.

Molecular Properties

Compound Name2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine
PubChem CID64942183
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine
SMILESCCCC1CN(CC2(C)CCCC2)C(C)CN1
InChIInChI=1S/C15H30N2/c1-4-7-14-11-17(13(2)10-16-14)12-15(3)8-5-6-9-15/h13-14,16H,4-12H2,1-3H3
InChIKeyYHSSGIGDGCDONY-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine?
The IUPAC name of 2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine (CID 64942183) is 2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine.
What is the SMILES notation for 2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine?
The canonical SMILES for 2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine is CCCC1CN(CC2(C)CCCC2)C(C)CN1.
What is the InChIKey of 2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine?
The InChIKey is YHSSGIGDGCDONY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-7-14-11-17(13(2)10-16-14)12-15(3)8-5-6-9-15/h13-14,16H,4-12H2,1-3H3.
What are the key properties of 2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine?
2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine has a molecular weight of 238.42 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(1-methylcyclopentyl)methyl]-5-propylpiperazine is sourced from PubChem (CID 64942183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).