7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide

C11H11N5O3 — CID 118712153

IUPAC7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
SMILESNC(=O)c1cc2c(=O)[nH]c(=O)n(C3CC3)c2nc1N
InChIInChI=1S/C11H11N5O3/c12-7-5(8(13)17)3-6-9(14-7)16(4-1-2-4)11(19)15-10(6)18/h3-4H,1-2H2,(H2,12,14)(H2,13,17)(H,15,18,19)
InChIKeyPSLNFGVYWZHYIF-UHFFFAOYSA-N
MW261.24 g/mol
LogP-0.90
Rot. Bonds2

About 7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide

7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide (PubChem CID 118712153) has the molecular formula C11H11N5O3 and a molecular weight of 261.24 g/mol. Its IUPAC name is 7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
PubChem CID118712153
Molecular FormulaC11H11N5O3
Molecular Weight261.24 g/mol
Exact Mass261.09
IUPAC Name7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
SMILESNC(=O)c1cc2c(=O)[nH]c(=O)n(C3CC3)c2nc1N
InChIInChI=1S/C11H11N5O3/c12-7-5(8(13)17)3-6-9(14-7)16(4-1-2-4)11(19)15-10(6)18/h3-4H,1-2H2,(H2,12,14)(H2,13,17)(H,15,18,19)
InChIKeyPSLNFGVYWZHYIF-UHFFFAOYSA-N
XLogP-0.90
TPSA136.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.24
LogP ≤ 5-0.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide?
The IUPAC name of 7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide (CID 118712153) is 7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide.
What is the SMILES notation for 7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide?
The canonical SMILES for 7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide is NC(=O)c1cc2c(=O)[nH]c(=O)n(C3CC3)c2nc1N.
What is the InChIKey of 7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide?
The InChIKey is PSLNFGVYWZHYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5O3/c12-7-5(8(13)17)3-6-9(14-7)16(4-1-2-4)11(19)15-10(6)18/h3-4H,1-2H2,(H2,12,14)(H2,13,17)(H,15,18,19).
What are the key properties of 7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide?
7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide has a molecular weight of 261.24 g/mol, XLogP of -0.90, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-1-cyclopropyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 118712153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).