5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine

C7H9N3 — CID 19828393

IUPAC5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine
SMILESc1ncc2c(n1)NCCC2
InChIInChI=1S/C7H9N3/c1-2-6-4-8-5-10-7(6)9-3-1/h4-5H,1-3H2,(H,8,9,10)
InChIKeyRKYBOAKGTWOIFJ-UHFFFAOYSA-N
MW135.17 g/mol
LogP0.83
Rot. Bonds

About 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine

5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine (PubChem CID 19828393) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine.

Molecular Properties

Compound Name5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine
PubChem CID19828393
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine
SMILESc1ncc2c(n1)NCCC2
InChIInChI=1S/C7H9N3/c1-2-6-4-8-5-10-7(6)9-3-1/h4-5H,1-3H2,(H,8,9,10)
InChIKeyRKYBOAKGTWOIFJ-UHFFFAOYSA-N
XLogP0.83
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine?
The IUPAC name of 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine (CID 19828393) is 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine.
What is the SMILES notation for 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine?
The canonical SMILES for 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine is c1ncc2c(n1)NCCC2.
What is the InChIKey of 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine?
The InChIKey is RKYBOAKGTWOIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c1-2-6-4-8-5-10-7(6)9-3-1/h4-5H,1-3H2,(H,8,9,10).
What are the key properties of 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine?
5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine has a molecular weight of 135.17 g/mol, XLogP of 0.83, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine is sourced from PubChem (CID 19828393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).