2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine

C14H30N2 — CID 22986339

IUPAC2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine
SMILESCCCN1CC(C)(C)N(C)C(C)(C)C1(C)C
InChIInChI=1S/C14H30N2/c1-9-10-16-11-12(2,3)15(8)13(4,5)14(16,6)7/h9-11H2,1-8H3
InChIKeyOZQAYPGWFHATFQ-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.98
Rot. Bonds2

About 2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine

2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine (PubChem CID 22986339) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine.

Molecular Properties

Compound Name2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine
PubChem CID22986339
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine
SMILESCCCN1CC(C)(C)N(C)C(C)(C)C1(C)C
InChIInChI=1S/C14H30N2/c1-9-10-16-11-12(2,3)15(8)13(4,5)14(16,6)7/h9-11H2,1-8H3
InChIKeyOZQAYPGWFHATFQ-UHFFFAOYSA-N
XLogP2.98
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine?
The IUPAC name of 2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine (CID 22986339) is 2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine.
What is the SMILES notation for 2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine?
The canonical SMILES for 2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine is CCCN1CC(C)(C)N(C)C(C)(C)C1(C)C.
What is the InChIKey of 2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine?
The InChIKey is OZQAYPGWFHATFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-9-10-16-11-12(2,3)15(8)13(4,5)14(16,6)7/h9-11H2,1-8H3.
What are the key properties of 2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine?
2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine has a molecular weight of 226.41 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3,4,5,5-heptamethyl-1-propylpiperazine is sourced from PubChem (CID 22986339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).