N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide

C14H16N4O4 — CID 134009005

IUPACN-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide
SMILESCn1c(=O)c2cc(NC(=O)C3CCCO3)cnc2n(C)c1=O
InChIInChI=1S/C14H16N4O4/c1-17-11-9(13(20)18(2)14(17)21)6-8(7-15-11)16-12(19)10-4-3-5-22-10/h6-7,10H,3-5H2,1-2H3,(H,16,19)
InChIKeyYDOJKSDUGMJZHC-UHFFFAOYSA-N
MW304.31 g/mol
LogP-0.25
Rot. Bonds2

About N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide

N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide (PubChem CID 134009005) has the molecular formula C14H16N4O4 and a molecular weight of 304.31 g/mol. Its IUPAC name is N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide
PubChem CID134009005
Molecular FormulaC14H16N4O4
Molecular Weight304.31 g/mol
Exact Mass304.12
IUPAC NameN-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide
SMILESCn1c(=O)c2cc(NC(=O)C3CCCO3)cnc2n(C)c1=O
InChIInChI=1S/C14H16N4O4/c1-17-11-9(13(20)18(2)14(17)21)6-8(7-15-11)16-12(19)10-4-3-5-22-10/h6-7,10H,3-5H2,1-2H3,(H,16,19)
InChIKeyYDOJKSDUGMJZHC-UHFFFAOYSA-N
XLogP-0.25
TPSA95.22 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-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 N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide?
The IUPAC name of N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide (CID 134009005) is N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide.
What is the SMILES notation for N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide?
The canonical SMILES for N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide is Cn1c(=O)c2cc(NC(=O)C3CCCO3)cnc2n(C)c1=O.
What is the InChIKey of N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide?
The InChIKey is YDOJKSDUGMJZHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O4/c1-17-11-9(13(20)18(2)14(17)21)6-8(7-15-11)16-12(19)10-4-3-5-22-10/h6-7,10H,3-5H2,1-2H3,(H,16,19).
What are the key properties of N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide?
N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide has a molecular weight of 304.31 g/mol, XLogP of -0.25, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)oxolane-2-carboxamide is sourced from PubChem (CID 134009005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).