1,3-bis(2,4,6-trimethylphenyl)imidazolidine

C21H28N2 — CID 2060893

IUPAC1,3-bis(2,4,6-trimethylphenyl)imidazolidine
SMILESCc1cc(C)c(N2CCN(c3c(C)cc(C)cc3C)C2)c(C)c1
InChIInChI=1S/C21H28N2/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6/h9-12H,7-8,13H2,1-6H3
InChIKeyRUKVGXGTVPPWDD-UHFFFAOYSA-N
MW308.47 g/mol
LogP4.82
Rot. Bonds2

About 1,3-bis(2,4,6-trimethylphenyl)imidazolidine

1,3-bis(2,4,6-trimethylphenyl)imidazolidine (PubChem CID 2060893) has the molecular formula C21H28N2 and a molecular weight of 308.47 g/mol. Its IUPAC name is 1,3-bis(2,4,6-trimethylphenyl)imidazolidine.

Molecular Properties

Compound Name1,3-bis(2,4,6-trimethylphenyl)imidazolidine
PubChem CID2060893
Molecular FormulaC21H28N2
Molecular Weight308.47 g/mol
Exact Mass308.23
IUPAC Name1,3-bis(2,4,6-trimethylphenyl)imidazolidine
SMILESCc1cc(C)c(N2CCN(c3c(C)cc(C)cc3C)C2)c(C)c1
InChIInChI=1S/C21H28N2/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6/h9-12H,7-8,13H2,1-6H3
InChIKeyRUKVGXGTVPPWDD-UHFFFAOYSA-N
XLogP4.82
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.47
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3-bis(2,4,6-trimethylphenyl)imidazolidine?
The IUPAC name of 1,3-bis(2,4,6-trimethylphenyl)imidazolidine (CID 2060893) is 1,3-bis(2,4,6-trimethylphenyl)imidazolidine.
What is the SMILES notation for 1,3-bis(2,4,6-trimethylphenyl)imidazolidine?
The canonical SMILES for 1,3-bis(2,4,6-trimethylphenyl)imidazolidine is Cc1cc(C)c(N2CCN(c3c(C)cc(C)cc3C)C2)c(C)c1.
What is the InChIKey of 1,3-bis(2,4,6-trimethylphenyl)imidazolidine?
The InChIKey is RUKVGXGTVPPWDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6/h9-12H,7-8,13H2,1-6H3.
What are the key properties of 1,3-bis(2,4,6-trimethylphenyl)imidazolidine?
1,3-bis(2,4,6-trimethylphenyl)imidazolidine has a molecular weight of 308.47 g/mol, XLogP of 4.82, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(2,4,6-trimethylphenyl)imidazolidine is sourced from PubChem (CID 2060893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).