5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine

C17H27N3 — CID 64934546

IUPAC5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine
SMILESCCC1CNC(C)(C2CC2)CN1C(C)c1cccnc1
InChIInChI=1S/C17H27N3/c1-4-16-11-19-17(3,15-7-8-15)12-20(16)13(2)14-6-5-9-18-10-14/h5-6,9-10,13,15-16,19H,4,7-8,11-12H2,1-3H3
InChIKeyIHWILHISDWHDFK-UHFFFAOYSA-N
MW273.42 g/mol
LogP3.00
Rot. Bonds4

About 5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine

5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine (PubChem CID 64934546) has the molecular formula C17H27N3 and a molecular weight of 273.42 g/mol. Its IUPAC name is 5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine.

Molecular Properties

Compound Name5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine
PubChem CID64934546
Molecular FormulaC17H27N3
Molecular Weight273.42 g/mol
Exact Mass273.22
IUPAC Name5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine
SMILESCCC1CNC(C)(C2CC2)CN1C(C)c1cccnc1
InChIInChI=1S/C17H27N3/c1-4-16-11-19-17(3,15-7-8-15)12-20(16)13(2)14-6-5-9-18-10-14/h5-6,9-10,13,15-16,19H,4,7-8,11-12H2,1-3H3
InChIKeyIHWILHISDWHDFK-UHFFFAOYSA-N
XLogP3.00
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-4-ylethyl)piperazine
CID 64935896
5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine
CID 64932001
1-[1-(4-chlorophenyl)ethyl]-2-ethyl-5,5-dimethylpiperazine
CID 64948195
3-cyclopropyl-3-methyl-1-pyridin-3-ylpiperazine
CID 64920015
2,3-dimethyl-1-(1-pyridin-3-ylethyl)piperidin-4-amine
CID 79396939
1-[1-(3-chlorophenyl)ethyl]-2,5-diethyl-5-methylpiperazine
CID 64945691
2-ethyl-5,5-dimethyl-1-(1-pyridin-2-ylethyl)piperazine
CID 64935510
5-cyclopropyl-2,5-dimethyl-1-propan-2-ylpiperazine
CID 64875943
5-cyclopropyl-2-ethyl-5-methyl-1-(2-pyridin-2-ylethyl)piperazine
CID 64935480
5-cyclopropyl-2,5-dimethyl-1-(1-thiophen-2-ylethyl)piperazine
CID 64933400
3-[(1R)-1-[(2S)-2-(1,2,4-triazol-1-ylmethyl)pyrrolidin-1-yl]ethyl]pyridine
CID 129461551
5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine
CID 64945697

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine?
The IUPAC name of 5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine (CID 64934546) is 5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine.
What is the SMILES notation for 5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine?
The canonical SMILES for 5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine is CCC1CNC(C)(C2CC2)CN1C(C)c1cccnc1.
What is the InChIKey of 5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine?
The InChIKey is IHWILHISDWHDFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3/c1-4-16-11-19-17(3,15-7-8-15)12-20(16)13(2)14-6-5-9-18-10-14/h5-6,9-10,13,15-16,19H,4,7-8,11-12H2,1-3H3.
What are the key properties of 5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine?
5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine has a molecular weight of 273.42 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine is sourced from PubChem (CID 64934546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).