4,6-dimethylpyrido[3,2-d]pyrimidine;ethane

C11H15N3 — CID 166106712

IUPAC4,6-dimethylpyrido[3,2-d]pyrimidine;ethane
SMILESCC.Cc1ccc2ncnc(C)c2n1
InChIInChI=1S/C9H9N3.C2H6/c1-6-3-4-8-9(12-6)7(2)10-5-11-8;1-2/h3-5H,1-2H3;1-2H3
InChIKeyYHLSWIHISFFIFG-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.67
Rot. Bonds

About 4,6-dimethylpyrido[3,2-d]pyrimidine;ethane

4,6-dimethylpyrido[3,2-d]pyrimidine;ethane (PubChem CID 166106712) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 4,6-dimethylpyrido[3,2-d]pyrimidine;ethane.

Molecular Properties

Compound Name4,6-dimethylpyrido[3,2-d]pyrimidine;ethane
PubChem CID166106712
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name4,6-dimethylpyrido[3,2-d]pyrimidine;ethane
SMILESCC.Cc1ccc2ncnc(C)c2n1
InChIInChI=1S/C9H9N3.C2H6/c1-6-3-4-8-9(12-6)7(2)10-5-11-8;1-2/h3-5H,1-2H3;1-2H3
InChIKeyYHLSWIHISFFIFG-UHFFFAOYSA-N
XLogP2.67
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethylpyrido[3,2-d]pyrimidine;ethane?
The IUPAC name of 4,6-dimethylpyrido[3,2-d]pyrimidine;ethane (CID 166106712) is 4,6-dimethylpyrido[3,2-d]pyrimidine;ethane.
What is the SMILES notation for 4,6-dimethylpyrido[3,2-d]pyrimidine;ethane?
The canonical SMILES for 4,6-dimethylpyrido[3,2-d]pyrimidine;ethane is CC.Cc1ccc2ncnc(C)c2n1.
What is the InChIKey of 4,6-dimethylpyrido[3,2-d]pyrimidine;ethane?
The InChIKey is YHLSWIHISFFIFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3.C2H6/c1-6-3-4-8-9(12-6)7(2)10-5-11-8;1-2/h3-5H,1-2H3;1-2H3.
What are the key properties of 4,6-dimethylpyrido[3,2-d]pyrimidine;ethane?
4,6-dimethylpyrido[3,2-d]pyrimidine;ethane has a molecular weight of 189.26 g/mol, XLogP of 2.67, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethylpyrido[3,2-d]pyrimidine;ethane is sourced from PubChem (CID 166106712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).