N-[(3S)-2,5-dioxooxolan-3-yl]formamide

C5H5NO4 — CID 11298025

IUPACN-[(3S)-2,5-dioxooxolan-3-yl]formamide
SMILESO=CN[C@H]1CC(=O)OC1=O
InChIInChI=1S/C5H5NO4/c7-2-6-3-1-4(8)10-5(3)9/h2-3H,1H2,(H,6,7)/t3-/m0/s1
InChIKeyDFTMVZIUYVECNW-VKHMYHEASA-N
MW143.10 g/mol
LogP-1.43
Rot. Bonds2

About N-[(3S)-2,5-dioxooxolan-3-yl]formamide

N-[(3S)-2,5-dioxooxolan-3-yl]formamide (PubChem CID 11298025) has the molecular formula C5H5NO4 and a molecular weight of 143.10 g/mol. Its IUPAC name is N-[(3S)-2,5-dioxooxolan-3-yl]formamide.

Molecular Properties

Compound NameN-[(3S)-2,5-dioxooxolan-3-yl]formamide
PubChem CID11298025
Molecular FormulaC5H5NO4
Molecular Weight143.10 g/mol
Exact Mass143.02
IUPAC NameN-[(3S)-2,5-dioxooxolan-3-yl]formamide
SMILESO=CN[C@H]1CC(=O)OC1=O
InChIInChI=1S/C5H5NO4/c7-2-6-3-1-4(8)10-5(3)9/h2-3H,1H2,(H,6,7)/t3-/m0/s1
InChIKeyDFTMVZIUYVECNW-VKHMYHEASA-N
XLogP-1.43
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.10
LogP ≤ 5-1.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(3S)-2,5-dioxooxolan-3-yl]formamide?
The IUPAC name of N-[(3S)-2,5-dioxooxolan-3-yl]formamide (CID 11298025) is N-[(3S)-2,5-dioxooxolan-3-yl]formamide.
What is the SMILES notation for N-[(3S)-2,5-dioxooxolan-3-yl]formamide?
The canonical SMILES for N-[(3S)-2,5-dioxooxolan-3-yl]formamide is O=CN[C@H]1CC(=O)OC1=O.
What is the InChIKey of N-[(3S)-2,5-dioxooxolan-3-yl]formamide?
The InChIKey is DFTMVZIUYVECNW-VKHMYHEASA-N. The full InChI is InChI=1S/C5H5NO4/c7-2-6-3-1-4(8)10-5(3)9/h2-3H,1H2,(H,6,7)/t3-/m0/s1.
What are the key properties of N-[(3S)-2,5-dioxooxolan-3-yl]formamide?
N-[(3S)-2,5-dioxooxolan-3-yl]formamide has a molecular weight of 143.10 g/mol, XLogP of -1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-2,5-dioxooxolan-3-yl]formamide is sourced from PubChem (CID 11298025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).