1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine

C14H28N2 — CID 107420870

IUPAC1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine
SMILESCC(C)C1CNCCN1CC1CCCC1C
InChIInChI=1S/C14H28N2/c1-11(2)14-9-15-7-8-16(14)10-13-6-4-5-12(13)3/h11-15H,4-10H2,1-3H3
InChIKeyXJSVPWFPQFEKHG-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.35
Rot. Bonds3

About 1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine

1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine (PubChem CID 107420870) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine
PubChem CID107420870
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine
SMILESCC(C)C1CNCCN1CC1CCCC1C
InChIInChI=1S/C14H28N2/c1-11(2)14-9-15-7-8-16(14)10-13-6-4-5-12(13)3/h11-15H,4-10H2,1-3H3
InChIKeyXJSVPWFPQFEKHG-UHFFFAOYSA-N
XLogP2.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine?
The IUPAC name of 1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine (CID 107420870) is 1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine.
What is the SMILES notation for 1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine?
The canonical SMILES for 1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine is CC(C)C1CNCCN1CC1CCCC1C.
What is the InChIKey of 1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine?
The InChIKey is XJSVPWFPQFEKHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-11(2)14-9-15-7-8-16(14)10-13-6-4-5-12(13)3/h11-15H,4-10H2,1-3H3.
What are the key properties of 1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine?
1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine has a molecular weight of 224.39 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine is sourced from PubChem (CID 107420870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).