5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine

C19H30N2 — CID 64935717

IUPAC5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine
SMILESCC(C)(C)CN1CC(C)(C2CC2)NCC1c1ccccc1
InChIInChI=1S/C19H30N2/c1-18(2,3)13-21-14-19(4,16-10-11-16)20-12-17(21)15-8-6-5-7-9-15/h5-9,16-17,20H,10-14H2,1-4H3
InChIKeyKVRNLOYJFRPKEX-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.85
Rot. Bonds3

About 5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine

5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine (PubChem CID 64935717) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine.

Molecular Properties

Compound Name5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine
PubChem CID64935717
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC Name5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine
SMILESCC(C)(C)CN1CC(C)(C2CC2)NCC1c1ccccc1
InChIInChI=1S/C19H30N2/c1-18(2,3)13-21-14-19(4,16-10-11-16)20-12-17(21)15-8-6-5-7-9-15/h5-9,16-17,20H,10-14H2,1-4H3
InChIKeyKVRNLOYJFRPKEX-UHFFFAOYSA-N
XLogP3.85
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,5-dicyclopropyl-5-methyl-2-phenylpiperazine
CID 64930453
1-cyclobutyl-5-cyclopropyl-5-methyl-2-phenylpiperazine
CID 64948501
5-cyclopropyl-5-methyl-2-phenyl-1-(thiolan-3-yl)piperazine
CID 103064937
1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine
CID 64935365
5-cyclopropyl-2,5-dimethyl-1-(4-phenylbutyl)piperazine
CID 114334950
5-cyclopropyl-2,5-dimethyl-1-phenylpiperazine
CID 64932614
1-(cyclohexylmethyl)-5,5-dimethyl-2-phenylpiperazine
CID 64840282
5-ethyl-1,5-dimethyl-2-phenylpiperazine
CID 64849289
5-cyclopropyl-1-[(2-fluorophenyl)methyl]-2,5-dimethylpiperazine
CID 64875570
5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine
CID 64932001
2-tert-butyl-5-cyclopropyl-5-methyl-1-[(1-methylpyrazol-3-yl)methyl]piperazine
CID 82872346
1-(2-butoxyethyl)-5,5-dimethyl-2-phenylpiperazine
CID 64839744

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine?
The IUPAC name of 5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine (CID 64935717) is 5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine.
What is the SMILES notation for 5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine?
The canonical SMILES for 5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine is CC(C)(C)CN1CC(C)(C2CC2)NCC1c1ccccc1.
What is the InChIKey of 5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine?
The InChIKey is KVRNLOYJFRPKEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-18(2,3)13-21-14-19(4,16-10-11-16)20-12-17(21)15-8-6-5-7-9-15/h5-9,16-17,20H,10-14H2,1-4H3.
What are the key properties of 5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine?
5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine has a molecular weight of 286.46 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-(2,2-dimethylpropyl)-5-methyl-2-phenylpiperazine is sourced from PubChem (CID 64935717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).