5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine

C15H25N3 — CID 138722622

IUPAC5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine
SMILESCC1CN2C(=N1)C=C(C(C)(C)C)N=C2C(C)(C)C
InChIInChI=1S/C15H25N3/c1-10-9-18-12(16-10)8-11(14(2,3)4)17-13(18)15(5,6)7/h8,10H,9H2,1-7H3
InChIKeyDSTZBUWFFZIZAL-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.48
Rot. Bonds

About 5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine

5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine (PubChem CID 138722622) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine.

Molecular Properties

Compound Name5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine
PubChem CID138722622
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine
SMILESCC1CN2C(=N1)C=C(C(C)(C)C)N=C2C(C)(C)C
InChIInChI=1S/C15H25N3/c1-10-9-18-12(16-10)8-11(14(2,3)4)17-13(18)15(5,6)7/h8,10H,9H2,1-7H3
InChIKeyDSTZBUWFFZIZAL-UHFFFAOYSA-N
XLogP3.48
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine?
The IUPAC name of 5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine (CID 138722622) is 5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine.
What is the SMILES notation for 5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine?
The canonical SMILES for 5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine is CC1CN2C(=N1)C=C(C(C)(C)C)N=C2C(C)(C)C.
What is the InChIKey of 5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine?
The InChIKey is DSTZBUWFFZIZAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-10-9-18-12(16-10)8-11(14(2,3)4)17-13(18)15(5,6)7/h8,10H,9H2,1-7H3.
What are the key properties of 5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine?
5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine has a molecular weight of 247.39 g/mol, XLogP of 3.48, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine is sourced from PubChem (CID 138722622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).