2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine

C15H30N2 — CID 64838594

IUPAC2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine
SMILESCCCC1CN(CC2CC2)C(C(C)(C)C)CN1
InChIInChI=1S/C15H30N2/c1-5-6-13-11-17(10-12-7-8-12)14(9-16-13)15(2,3)4/h12-14,16H,5-11H2,1-4H3
InChIKeyCZQTWSMEJSZVEI-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.88
Rot. Bonds4

About 2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine

2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine (PubChem CID 64838594) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine.

Molecular Properties

Compound Name2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine
PubChem CID64838594
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine
SMILESCCCC1CN(CC2CC2)C(C(C)(C)C)CN1
InChIInChI=1S/C15H30N2/c1-5-6-13-11-17(10-12-7-8-12)14(9-16-13)15(2,3)4/h12-14,16H,5-11H2,1-4H3
InChIKeyCZQTWSMEJSZVEI-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine?
The IUPAC name of 2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine (CID 64838594) is 2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine.
What is the SMILES notation for 2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine?
The canonical SMILES for 2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine is CCCC1CN(CC2CC2)C(C(C)(C)C)CN1.
What is the InChIKey of 2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine?
The InChIKey is CZQTWSMEJSZVEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-5-6-13-11-17(10-12-7-8-12)14(9-16-13)15(2,3)4/h12-14,16H,5-11H2,1-4H3.
What are the key properties of 2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine?
2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine has a molecular weight of 238.42 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine is sourced from PubChem (CID 64838594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).