6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine

C15H16N6 — CID 155562818

IUPAC6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine
SMILESCCN(c1ccccc1)c1ccc2nc(N)nc(N)c2n1
InChIInChI=1S/C15H16N6/c1-2-21(10-6-4-3-5-7-10)12-9-8-11-13(19-12)14(16)20-15(17)18-11/h3-9H,2H2,1H3,(H4,16,17,18,20)
InChIKeyYFYHIAAYGIAXRD-UHFFFAOYSA-N
MW280.34 g/mol
LogP2.35
Rot. Bonds3

About 6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine

6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine (PubChem CID 155562818) has the molecular formula C15H16N6 and a molecular weight of 280.34 g/mol. Its IUPAC name is 6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine.

Molecular Properties

Compound Name6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine
PubChem CID155562818
Molecular FormulaC15H16N6
Molecular Weight280.34 g/mol
Exact Mass280.14
IUPAC Name6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine
SMILESCCN(c1ccccc1)c1ccc2nc(N)nc(N)c2n1
InChIInChI=1S/C15H16N6/c1-2-21(10-6-4-3-5-7-10)12-9-8-11-13(19-12)14(16)20-15(17)18-11/h3-9H,2H2,1H3,(H4,16,17,18,20)
InChIKeyYFYHIAAYGIAXRD-UHFFFAOYSA-N
XLogP2.35
TPSA93.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine?
The IUPAC name of 6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine (CID 155562818) is 6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine.
What is the SMILES notation for 6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine?
The canonical SMILES for 6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine is CCN(c1ccccc1)c1ccc2nc(N)nc(N)c2n1.
What is the InChIKey of 6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine?
The InChIKey is YFYHIAAYGIAXRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6/c1-2-21(10-6-4-3-5-7-10)12-9-8-11-13(19-12)14(16)20-15(17)18-11/h3-9H,2H2,1H3,(H4,16,17,18,20).
What are the key properties of 6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine?
6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine has a molecular weight of 280.34 g/mol, XLogP of 2.35, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-6-N-phenylpyrido[3,2-d]pyrimidine-2,4,6-triamine is sourced from PubChem (CID 155562818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).