1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine

C16H24N2 — CID 64935189

IUPAC1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine
SMILESCC1CNC(c2ccccc2)CN1CC1CCC1
InChIInChI=1S/C16H24N2/c1-13-10-17-16(15-8-3-2-4-9-15)12-18(13)11-14-6-5-7-14/h2-4,8-9,13-14,16-17H,5-7,10-12H2,1H3
InChIKeyMJOFPKTYJKARIW-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.82
Rot. Bonds3

About 1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine

1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine (PubChem CID 64935189) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine.

Molecular Properties

Compound Name1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine
PubChem CID64935189
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine
SMILESCC1CNC(c2ccccc2)CN1CC1CCC1
InChIInChI=1S/C16H24N2/c1-13-10-17-16(15-8-3-2-4-9-15)12-18(13)11-14-6-5-7-14/h2-4,8-9,13-14,16-17H,5-7,10-12H2,1H3
InChIKeyMJOFPKTYJKARIW-UHFFFAOYSA-N
XLogP2.82
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine?
The IUPAC name of 1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine (CID 64935189) is 1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine.
What is the SMILES notation for 1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine?
The canonical SMILES for 1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine is CC1CNC(c2ccccc2)CN1CC1CCC1.
What is the InChIKey of 1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine?
The InChIKey is MJOFPKTYJKARIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-13-10-17-16(15-8-3-2-4-9-15)12-18(13)11-14-6-5-7-14/h2-4,8-9,13-14,16-17H,5-7,10-12H2,1H3.
What are the key properties of 1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine?
1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine has a molecular weight of 244.38 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethyl)-2-methyl-5-phenylpiperazine is sourced from PubChem (CID 64935189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).