5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine

C14H24N2S — CID 64843483

IUPAC5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine
SMILESCCC1CN(Cc2cccs2)C(C(C)C)CN1
InChIInChI=1S/C14H24N2S/c1-4-12-9-16(10-13-6-5-7-17-13)14(8-15-12)11(2)3/h5-7,11-12,14-15H,4,8-10H2,1-3H3
InChIKeyUZCOZHFROASNMY-UHFFFAOYSA-N
MW252.43 g/mol
LogP2.96
Rot. Bonds4

About 5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine

5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine (PubChem CID 64843483) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine.

Molecular Properties

Compound Name5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine
PubChem CID64843483
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine
SMILESCCC1CN(Cc2cccs2)C(C(C)C)CN1
InChIInChI=1S/C14H24N2S/c1-4-12-9-16(10-13-6-5-7-17-13)14(8-15-12)11(2)3/h5-7,11-12,14-15H,4,8-10H2,1-3H3
InChIKeyUZCOZHFROASNMY-UHFFFAOYSA-N
XLogP2.96
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-butan-2-yl-5-propyl-1-(thiophen-2-ylmethyl)piperazine
CID 64839947
5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine
CID 64876116
1-[(2,6-difluorophenyl)methyl]-5-ethyl-2-propan-2-ylpiperazine
CID 114934592
5-[(5-ethyl-2-propan-2-ylpiperazin-1-yl)methyl]-2-methyl-1,3-thiazole
CID 64946669
2-butan-2-yl-5-cyclopropyl-1-(thiophen-2-ylmethyl)piperazine
CID 64862427
1-[(3,4-dimethylphenyl)methyl]-5-ethyl-2-propan-2-ylpiperazine
CID 64842124
1-[(5-chloro-2-fluorophenyl)methyl]-5-ethyl-2-propan-2-ylpiperazine
CID 103050775
2-cyclopropyl-5-ethyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64843303
2-butan-2-yl-5-(2-methylpropyl)-1-(2-thiophen-2-ylethyl)piperazine
CID 64849704
5-ethyl-1-(2-methylpropyl)-2-propan-2-ylpiperazine
CID 64843674
3-propan-2-yl-2-(thiophen-2-ylmethyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 79939527
5-[(2-propan-2-yl-5-propylpiperazin-1-yl)methyl]-1,3-thiazole
CID 112644843

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine?
The IUPAC name of 5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine (CID 64843483) is 5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine.
What is the SMILES notation for 5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine?
The canonical SMILES for 5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine is CCC1CN(Cc2cccs2)C(C(C)C)CN1.
What is the InChIKey of 5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine?
The InChIKey is UZCOZHFROASNMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-4-12-9-16(10-13-6-5-7-17-13)14(8-15-12)11(2)3/h5-7,11-12,14-15H,4,8-10H2,1-3H3.
What are the key properties of 5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine?
5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine has a molecular weight of 252.43 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine is sourced from PubChem (CID 64843483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).