6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine

C15H15N5 — CID 5328116

IUPAC6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine
SMILESCc1cccc(C)c1-c1cc2cnc(N)nc2nc1N
InChIInChI=1S/C15H15N5/c1-8-4-3-5-9(2)12(8)11-6-10-7-18-15(17)20-14(10)19-13(11)16/h3-7H,1-2H3,(H4,16,17,18,19,20)
InChIKeyLSHICSIXTRDLPS-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.47
Rot. Bonds1

About 6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine

6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine (PubChem CID 5328116) has the molecular formula C15H15N5 and a molecular weight of 265.32 g/mol. Its IUPAC name is 6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine.

Molecular Properties

Compound Name6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine
PubChem CID5328116
Molecular FormulaC15H15N5
Molecular Weight265.32 g/mol
Exact Mass265.13
IUPAC Name6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine
SMILESCc1cccc(C)c1-c1cc2cnc(N)nc2nc1N
InChIInChI=1S/C15H15N5/c1-8-4-3-5-9(2)12(8)11-6-10-7-18-15(17)20-14(10)19-13(11)16/h3-7H,1-2H3,(H4,16,17,18,19,20)
InChIKeyLSHICSIXTRDLPS-UHFFFAOYSA-N
XLogP2.47
TPSA90.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine?
The IUPAC name of 6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine (CID 5328116) is 6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine.
What is the SMILES notation for 6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine?
The canonical SMILES for 6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine is Cc1cccc(C)c1-c1cc2cnc(N)nc2nc1N.
What is the InChIKey of 6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine?
The InChIKey is LSHICSIXTRDLPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5/c1-8-4-3-5-9(2)12(8)11-6-10-7-18-15(17)20-14(10)19-13(11)16/h3-7H,1-2H3,(H4,16,17,18,19,20).
What are the key properties of 6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine?
6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine has a molecular weight of 265.32 g/mol, XLogP of 2.47, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-dimethylphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine is sourced from PubChem (CID 5328116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).