2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine

C17H36N2 — CID 140580755

IUPAC2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine
SMILESCCC(C)(C)C1NC(C(C)(C)C)NC1C(C)(C)CC
InChIInChI=1S/C17H36N2/c1-10-16(6,7)12-13(17(8,9)11-2)19-14(18-12)15(3,4)5/h12-14,18-19H,10-11H2,1-9H3
InChIKeyDUBYTIYDSVNNIG-UHFFFAOYSA-N
MW268.49 g/mol
LogP4.16
Rot. Bonds4

About 2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine

2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine (PubChem CID 140580755) has the molecular formula C17H36N2 and a molecular weight of 268.49 g/mol. Its IUPAC name is 2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine.

Molecular Properties

Compound Name2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine
PubChem CID140580755
Molecular FormulaC17H36N2
Molecular Weight268.49 g/mol
Exact Mass268.29
IUPAC Name2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine
SMILESCCC(C)(C)C1NC(C(C)(C)C)NC1C(C)(C)CC
InChIInChI=1S/C17H36N2/c1-10-16(6,7)12-13(17(8,9)11-2)19-14(18-12)15(3,4)5/h12-14,18-19H,10-11H2,1-9H3
InChIKeyDUBYTIYDSVNNIG-UHFFFAOYSA-N
XLogP4.16
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.49
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine?
The IUPAC name of 2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine (CID 140580755) is 2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine.
What is the SMILES notation for 2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine?
The canonical SMILES for 2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine is CCC(C)(C)C1NC(C(C)(C)C)NC1C(C)(C)CC.
What is the InChIKey of 2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine?
The InChIKey is DUBYTIYDSVNNIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2/c1-10-16(6,7)12-13(17(8,9)11-2)19-14(18-12)15(3,4)5/h12-14,18-19H,10-11H2,1-9H3.
What are the key properties of 2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine?
2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine has a molecular weight of 268.49 g/mol, XLogP of 4.16, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-4,5-bis(2-methylbutan-2-yl)imidazolidine is sourced from PubChem (CID 140580755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).