6-methylpyrido[3,2-d]pyrimidine-2,4-diamine

C8H9N5 — CID 600147

IUPAC6-methylpyrido[3,2-d]pyrimidine-2,4-diamine
SMILESCc1ccc2nc(N)nc(N)c2n1
InChIInChI=1S/C8H9N5/c1-4-2-3-5-6(11-4)7(9)13-8(10)12-5/h2-3H,1H3,(H4,9,10,12,13)
InChIKeyKWSKLIPMPQVKNI-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.50
Rot. Bonds

About 6-methylpyrido[3,2-d]pyrimidine-2,4-diamine

6-methylpyrido[3,2-d]pyrimidine-2,4-diamine (PubChem CID 600147) has the molecular formula C8H9N5 and a molecular weight of 175.19 g/mol. Its IUPAC name is 6-methylpyrido[3,2-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-methylpyrido[3,2-d]pyrimidine-2,4-diamine
PubChem CID600147
Molecular FormulaC8H9N5
Molecular Weight175.19 g/mol
Exact Mass175.09
IUPAC Name6-methylpyrido[3,2-d]pyrimidine-2,4-diamine
SMILESCc1ccc2nc(N)nc(N)c2n1
InChIInChI=1S/C8H9N5/c1-4-2-3-5-6(11-4)7(9)13-8(10)12-5/h2-3H,1H3,(H4,9,10,12,13)
InChIKeyKWSKLIPMPQVKNI-UHFFFAOYSA-N
XLogP0.50
TPSA90.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methylpyrido[3,2-d]pyrimidine-2,4-diamine?
The IUPAC name of 6-methylpyrido[3,2-d]pyrimidine-2,4-diamine (CID 600147) is 6-methylpyrido[3,2-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 6-methylpyrido[3,2-d]pyrimidine-2,4-diamine?
The canonical SMILES for 6-methylpyrido[3,2-d]pyrimidine-2,4-diamine is Cc1ccc2nc(N)nc(N)c2n1.
What is the InChIKey of 6-methylpyrido[3,2-d]pyrimidine-2,4-diamine?
The InChIKey is KWSKLIPMPQVKNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5/c1-4-2-3-5-6(11-4)7(9)13-8(10)12-5/h2-3H,1H3,(H4,9,10,12,13).
What are the key properties of 6-methylpyrido[3,2-d]pyrimidine-2,4-diamine?
6-methylpyrido[3,2-d]pyrimidine-2,4-diamine has a molecular weight of 175.19 g/mol, XLogP of 0.50, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylpyrido[3,2-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 600147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).