1,2-dihydropyrido[4,3-d]pyrimidine

C7H7N3 — CID 19831855

IUPAC1,2-dihydropyrido[4,3-d]pyrimidine
SMILESC1=NCNc2ccncc21
InChIInChI=1S/C7H7N3/c1-2-8-3-6-4-9-5-10-7(1)6/h1-4,10H,5H2
InChIKeyKNDNEGLEJQSTEH-UHFFFAOYSA-N
MW133.15 g/mol
LogP0.88
Rot. Bonds

About 1,2-dihydropyrido[4,3-d]pyrimidine

1,2-dihydropyrido[4,3-d]pyrimidine (PubChem CID 19831855) has the molecular formula C7H7N3 and a molecular weight of 133.15 g/mol. Its IUPAC name is 1,2-dihydropyrido[4,3-d]pyrimidine.

Molecular Properties

Compound Name1,2-dihydropyrido[4,3-d]pyrimidine
PubChem CID19831855
Molecular FormulaC7H7N3
Molecular Weight133.15 g/mol
Exact Mass133.06
IUPAC Name1,2-dihydropyrido[4,3-d]pyrimidine
SMILESC1=NCNc2ccncc21
InChIInChI=1S/C7H7N3/c1-2-8-3-6-4-9-5-10-7(1)6/h1-4,10H,5H2
InChIKeyKNDNEGLEJQSTEH-UHFFFAOYSA-N
XLogP0.88
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,2-dihydropyrido[4,3-d]pyrimidine?
The IUPAC name of 1,2-dihydropyrido[4,3-d]pyrimidine (CID 19831855) is 1,2-dihydropyrido[4,3-d]pyrimidine.
What is the SMILES notation for 1,2-dihydropyrido[4,3-d]pyrimidine?
The canonical SMILES for 1,2-dihydropyrido[4,3-d]pyrimidine is C1=NCNc2ccncc21.
What is the InChIKey of 1,2-dihydropyrido[4,3-d]pyrimidine?
The InChIKey is KNDNEGLEJQSTEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3/c1-2-8-3-6-4-9-5-10-7(1)6/h1-4,10H,5H2.
What are the key properties of 1,2-dihydropyrido[4,3-d]pyrimidine?
1,2-dihydropyrido[4,3-d]pyrimidine has a molecular weight of 133.15 g/mol, XLogP of 0.88, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dihydropyrido[4,3-d]pyrimidine is sourced from PubChem (CID 19831855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).