6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione

C7H6N4O2 — CID 822181

IUPAC6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione
SMILESNc1cnc2[nH]c(=O)[nH]c(=O)c2c1
InChIInChI=1S/C7H6N4O2/c8-3-1-4-5(9-2-3)10-7(13)11-6(4)12/h1-2H,8H2,(H2,9,10,11,12,13)
InChIKeyFQFUPPJKZAFGSY-UHFFFAOYSA-N
MW178.15 g/mol
LogP-0.81
Rot. Bonds

About 6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione

6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 822181) has the molecular formula C7H6N4O2 and a molecular weight of 178.15 g/mol. Its IUPAC name is 6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID822181
Molecular FormulaC7H6N4O2
Molecular Weight178.15 g/mol
Exact Mass178.05
IUPAC Name6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione
SMILESNc1cnc2[nH]c(=O)[nH]c(=O)c2c1
InChIInChI=1S/C7H6N4O2/c8-3-1-4-5(9-2-3)10-7(13)11-6(4)12/h1-2H,8H2,(H2,9,10,11,12,13)
InChIKeyFQFUPPJKZAFGSY-UHFFFAOYSA-N
XLogP-0.81
TPSA104.63 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.15
LogP ≤ 5-0.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione (CID 822181) is 6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione is Nc1cnc2[nH]c(=O)[nH]c(=O)c2c1.
What is the InChIKey of 6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is FQFUPPJKZAFGSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N4O2/c8-3-1-4-5(9-2-3)10-7(13)11-6(4)12/h1-2H,8H2,(H2,9,10,11,12,13).
What are the key properties of 6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione?
6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 178.15 g/mol, XLogP of -0.81, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1H-pyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 822181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).