1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine

C17H28N2O — CID 64933006

IUPAC1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine
SMILESCCCC1CN(c2cccc(OC)c2)C(C(C)C)CN1
InChIInChI=1S/C17H28N2O/c1-5-7-14-12-19(17(11-18-14)13(2)3)15-8-6-9-16(10-15)20-4/h6,8-10,13-14,17-18H,5,7,11-12H2,1-4H3
InChIKeySFICSRHHDPWLGB-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.30
Rot. Bonds5

About 1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine

1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine (PubChem CID 64933006) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine
PubChem CID64933006
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine
SMILESCCCC1CN(c2cccc(OC)c2)C(C(C)C)CN1
InChIInChI=1S/C17H28N2O/c1-5-7-14-12-19(17(11-18-14)13(2)3)15-8-6-9-16(10-15)20-4/h6,8-10,13-14,17-18H,5,7,11-12H2,1-4H3
InChIKeySFICSRHHDPWLGB-UHFFFAOYSA-N
XLogP3.30
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-1-(3-methoxyphenyl)-2-propan-2-ylpiperazine
CID 64932840
1-(4-fluoro-3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine
CID 114840951
1-(2,3-dihydro-1H-inden-5-yl)-2-propan-2-yl-5-propylpiperazine
CID 64930588
1-(3-fluoro-4-methylphenyl)-2-propan-2-yl-5-propylpiperazine
CID 64930640
5-ethyl-1-phenyl-2-propan-2-ylpiperazine
CID 64930277
5-ethyl-1-(4-methoxy-2-methylphenyl)-2-propan-2-ylpiperazine
CID 64942325
2-ethyl-1-(3-propan-2-ylphenyl)-5-propylpiperazine
CID 64933250
5-ethyl-1-(4-fluoro-3-methoxyphenyl)-2-propan-2-ylpiperazine
CID 114840927
1-(4-fluoro-2-methylphenyl)-2-propan-2-yl-5-propylpiperazine
CID 64932857
1-(4-bromo-2-methylphenyl)-2-propan-2-yl-5-propylpiperazine
CID 64934509
1-(5-chloro-2-methylphenyl)-2-propan-2-yl-5-propylpiperazine
CID 64933308
1-(5-bromo-2-chlorophenyl)-2-propan-2-yl-5-propylpiperazine
CID 64939430

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine?
The IUPAC name of 1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine (CID 64933006) is 1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine.
What is the SMILES notation for 1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine?
The canonical SMILES for 1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine is CCCC1CN(c2cccc(OC)c2)C(C(C)C)CN1.
What is the InChIKey of 1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine?
The InChIKey is SFICSRHHDPWLGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-5-7-14-12-19(17(11-18-14)13(2)3)15-8-6-9-16(10-15)20-4/h6,8-10,13-14,17-18H,5,7,11-12H2,1-4H3.
What are the key properties of 1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine?
1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine has a molecular weight of 276.42 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-2-propan-2-yl-5-propylpiperazine is sourced from PubChem (CID 64933006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).