1,3-dimethyl-2,5-dihydropteridine

C8H12N4 — CID 21146665

IUPAC1,3-dimethyl-2,5-dihydropteridine
SMILESCN1C=C2NC=CN=C2N(C)C1
InChIInChI=1S/C8H12N4/c1-11-5-7-8(12(2)6-11)10-4-3-9-7/h3-5,9H,6H2,1-2H3
InChIKeyFDNIDYIPNVVRTJ-UHFFFAOYSA-N
MW164.21 g/mol
LogP0.14
Rot. Bonds

About 1,3-dimethyl-2,5-dihydropteridine

1,3-dimethyl-2,5-dihydropteridine (PubChem CID 21146665) has the molecular formula C8H12N4 and a molecular weight of 164.21 g/mol. Its IUPAC name is 1,3-dimethyl-2,5-dihydropteridine.

Molecular Properties

Compound Name1,3-dimethyl-2,5-dihydropteridine
PubChem CID21146665
Molecular FormulaC8H12N4
Molecular Weight164.21 g/mol
Exact Mass164.11
IUPAC Name1,3-dimethyl-2,5-dihydropteridine
SMILESCN1C=C2NC=CN=C2N(C)C1
InChIInChI=1S/C8H12N4/c1-11-5-7-8(12(2)6-11)10-4-3-9-7/h3-5,9H,6H2,1-2H3
InChIKeyFDNIDYIPNVVRTJ-UHFFFAOYSA-N
XLogP0.14
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-2,5-dihydropteridine?
The IUPAC name of 1,3-dimethyl-2,5-dihydropteridine (CID 21146665) is 1,3-dimethyl-2,5-dihydropteridine.
What is the SMILES notation for 1,3-dimethyl-2,5-dihydropteridine?
The canonical SMILES for 1,3-dimethyl-2,5-dihydropteridine is CN1C=C2NC=CN=C2N(C)C1.
What is the InChIKey of 1,3-dimethyl-2,5-dihydropteridine?
The InChIKey is FDNIDYIPNVVRTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4/c1-11-5-7-8(12(2)6-11)10-4-3-9-7/h3-5,9H,6H2,1-2H3.
What are the key properties of 1,3-dimethyl-2,5-dihydropteridine?
1,3-dimethyl-2,5-dihydropteridine has a molecular weight of 164.21 g/mol, XLogP of 0.14, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-2,5-dihydropteridine is sourced from PubChem (CID 21146665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).