2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine

C17H28N2 — CID 64953104

IUPAC2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine
SMILESCCc1cccc(N2CC(C(C)C)NCC2CC)c1
InChIInChI=1S/C17H28N2/c1-5-14-8-7-9-16(10-14)19-12-17(13(3)4)18-11-15(19)6-2/h7-10,13,15,17-18H,5-6,11-12H2,1-4H3
InChIKeyJDNHWGTVWDOLCR-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.46
Rot. Bonds4

About 2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine

2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine (PubChem CID 64953104) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is 2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine.

Molecular Properties

Compound Name2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine
PubChem CID64953104
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC Name2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine
SMILESCCc1cccc(N2CC(C(C)C)NCC2CC)c1
InChIInChI=1S/C17H28N2/c1-5-14-8-7-9-16(10-14)19-12-17(13(3)4)18-11-15(19)6-2/h7-10,13,15,17-18H,5-6,11-12H2,1-4H3
InChIKeyJDNHWGTVWDOLCR-UHFFFAOYSA-N
XLogP3.46
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-1-(4-iodophenyl)-5-propan-2-ylpiperazine
CID 64936947
1-(4-tert-butylphenyl)-2-ethyl-5-propan-2-ylpiperazine
CID 64952670
2-ethyl-1-(4-methoxyphenyl)-5-propan-2-ylpiperazine
CID 64954255
2-ethyl-5-propan-2-yl-1-thiophen-3-ylpiperazine
CID 66354997
1-(2-chloro-6-methylphenyl)-2-ethyl-5-propan-2-ylpiperazine
CID 66255306
1-(4-bromo-2-ethylphenyl)-2-ethyl-5-propan-2-ylpiperazine
CID 81288854
2-ethyl-5-propan-2-yl-1-(2,4,5-trichlorophenyl)piperazine
CID 64937128
2-ethyl-1-(2-fluoro-5-methylphenyl)-5-propan-2-ylpiperazine
CID 64952890
2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine
CID 64952301
2-ethyl-1-(1-phenylpropan-2-yl)-5-propan-2-ylpiperazine
CID 64937812
5-cyclopropyl-2-ethyl-1-[3-(methoxymethyl)phenyl]piperazine
CID 64946841
5-cyclopropyl-2-ethyl-1-(3-propan-2-ylphenyl)piperazine
CID 64933251

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine?
The IUPAC name of 2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine (CID 64953104) is 2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine.
What is the SMILES notation for 2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine?
The canonical SMILES for 2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine is CCc1cccc(N2CC(C(C)C)NCC2CC)c1.
What is the InChIKey of 2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine?
The InChIKey is JDNHWGTVWDOLCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-5-14-8-7-9-16(10-14)19-12-17(13(3)4)18-11-15(19)6-2/h7-10,13,15,17-18H,5-6,11-12H2,1-4H3.
What are the key properties of 2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine?
2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine has a molecular weight of 260.43 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(3-ethylphenyl)-5-propan-2-ylpiperazine is sourced from PubChem (CID 64953104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).