1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide

C16H20N4O4 — CID 35252385

About 1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide

1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide (PubChem CID 35252385) has the molecular formula C16H20N4O4 and a molecular weight of 332.36 g/mol. Its IUPAC name is 1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide.

Molecular Properties

• Compound Name: 1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide
• PubChem CID: 35252385
• Molecular Formula: C16H20N4O4
• Molecular Weight: 332.36 g/mol
• Exact Mass: 332.15
• IUPAC Name: 1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide
• SMILES: C[C@@H](NC(=O)c1cnc2c(c1)c(=O)n(C)c(=O)n2C)[C@@H]1CCCO1
• InChI: InChI=1S/C16H20N4O4/c1-9(12-5-4-6-24-12)18-14(21)10-7-11-13(17-8-10)19(2)16(23)20(3)15(11)22/h7-9,12H,4-6H2,1-3H3,(H,18,21)/t9-,12+/m1/s1
• InChIKey: YCUZSJFZAPXIQS-SKDRFNHKSA-N
• XLogP: -0.07
• TPSA: 95.22 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 3
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	332.36
LogP ≤ 5	-0.07
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide?

The IUPAC name of 1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide (CID 35252385) is 1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide.

What is the SMILES notation for 1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide?

The canonical SMILES for 1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide is C[C@@H](NC(=O)c1cnc2c(c1)c(=O)n(C)c(=O)n2C)[C@@H]1CCCO1.

What is the InChIKey of 1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide?

The InChIKey is YCUZSJFZAPXIQS-SKDRFNHKSA-N. The full InChI is InChI=1S/C16H20N4O4/c1-9(12-5-4-6-24-12)18-14(21)10-7-11-13(17-8-10)19(2)16(23)20(3)15(11)22/h7-9,12H,4-6H2,1-3H3,(H,18,21)/t9-,12+/m1/s1.

What are the key properties of 1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide?

1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide has a molecular weight of 332.36 g/mol, XLogP of -0.07, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1,3-dimethyl-2,4-dioxo-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 35252385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).