1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine

C18H30N2O — CID 104766308

IUPAC1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine
SMILESCCCC1CN(CC(C)(C)OC)C(c2ccccc2)CN1
InChIInChI=1S/C18H30N2O/c1-5-9-16-13-20(14-18(2,3)21-4)17(12-19-16)15-10-7-6-8-11-15/h6-8,10-11,16-17,19H,5,9,12-14H2,1-4H3
InChIKeySCPORNHQEUUAAB-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.23
Rot. Bonds6

About 1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine

1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine (PubChem CID 104766308) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is 1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine.

Molecular Properties

Compound Name1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine
PubChem CID104766308
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine
SMILESCCCC1CN(CC(C)(C)OC)C(c2ccccc2)CN1
InChIInChI=1S/C18H30N2O/c1-5-9-16-13-20(14-18(2,3)21-4)17(12-19-16)15-10-7-6-8-11-15/h6-8,10-11,16-17,19H,5,9,12-14H2,1-4H3
InChIKeySCPORNHQEUUAAB-UHFFFAOYSA-N
XLogP3.23
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopropyl-1-(2-methoxy-2-methylpropyl)-2-phenylpiperazine
CID 104766324
N,N-dimethyl-3-(2-phenyl-5-propylpiperazin-1-yl)propan-1-amine
CID 64934814
1-benzyl-5-ethyl-2-phenylpiperazine
CID 64841572
1-(3-methoxy-3-methylbutyl)-2,5-dipropylpiperazine
CID 103016279
3-(2-methoxy-2-methylpropyl)-5-phenyl-2-propylimidazolidin-4-one
CID 104767743
1-(cyclobutylmethyl)-5-ethyl-2-phenylpiperazine
CID 64935193
5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine
CID 64940985
1-[(2-methoxyphenyl)methyl]-2-methyl-5-propylpiperazine
CID 64846377
5-ethyl-2-phenyl-1-(pyridin-4-ylmethyl)piperazine
CID 64841963
2-methyl-1-(3-phenoxypropyl)-5-propylpiperazine
CID 64846367
1-benzyl-2-cyclopropyl-5-propylpiperazine
CID 64839373
5-ethyl-1-hex-5-ynyl-2-phenylpiperazine
CID 106211749

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine?
The IUPAC name of 1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine (CID 104766308) is 1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine.
What is the SMILES notation for 1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine?
The canonical SMILES for 1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine is CCCC1CN(CC(C)(C)OC)C(c2ccccc2)CN1.
What is the InChIKey of 1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine?
The InChIKey is SCPORNHQEUUAAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-5-9-16-13-20(14-18(2,3)21-4)17(12-19-16)15-10-7-6-8-11-15/h6-8,10-11,16-17,19H,5,9,12-14H2,1-4H3.
What are the key properties of 1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine?
1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine has a molecular weight of 290.45 g/mol, XLogP of 3.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-2-methylpropyl)-2-phenyl-5-propylpiperazine is sourced from PubChem (CID 104766308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).