6-(2,2-dimethylpropyl)pteridine

C11H14N4 — CID 118285087

IUPAC6-(2,2-dimethylpropyl)pteridine
SMILESCC(C)(C)Cc1cnc2ncncc2n1
InChIInChI=1S/C11H14N4/c1-11(2,3)4-8-5-13-10-9(15-8)6-12-7-14-10/h5-7H,4H2,1-3H3
InChIKeyIBROZBDTPSIYEM-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.01
Rot. Bonds1

About 6-(2,2-dimethylpropyl)pteridine

6-(2,2-dimethylpropyl)pteridine (PubChem CID 118285087) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is 6-(2,2-dimethylpropyl)pteridine.

Molecular Properties

Compound Name6-(2,2-dimethylpropyl)pteridine
PubChem CID118285087
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC Name6-(2,2-dimethylpropyl)pteridine
SMILESCC(C)(C)Cc1cnc2ncncc2n1
InChIInChI=1S/C11H14N4/c1-11(2,3)4-8-5-13-10-9(15-8)6-12-7-14-10/h5-7H,4H2,1-3H3
InChIKeyIBROZBDTPSIYEM-UHFFFAOYSA-N
XLogP2.01
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2,2-dimethylpropyl)pteridine?
The IUPAC name of 6-(2,2-dimethylpropyl)pteridine (CID 118285087) is 6-(2,2-dimethylpropyl)pteridine.
What is the SMILES notation for 6-(2,2-dimethylpropyl)pteridine?
The canonical SMILES for 6-(2,2-dimethylpropyl)pteridine is CC(C)(C)Cc1cnc2ncncc2n1.
What is the InChIKey of 6-(2,2-dimethylpropyl)pteridine?
The InChIKey is IBROZBDTPSIYEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c1-11(2,3)4-8-5-13-10-9(15-8)6-12-7-14-10/h5-7H,4H2,1-3H3.
What are the key properties of 6-(2,2-dimethylpropyl)pteridine?
6-(2,2-dimethylpropyl)pteridine has a molecular weight of 202.26 g/mol, XLogP of 2.01, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2-dimethylpropyl)pteridine is sourced from PubChem (CID 118285087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).