N-methoxy-N,3-dimethyloxirane-2-carboxamide

C6H11NO3 — CID 71435783

IUPACN-methoxy-N,3-dimethyloxirane-2-carboxamide
SMILESCON(C)C(=O)C1OC1C
InChIInChI=1S/C6H11NO3/c1-4-5(10-4)6(8)7(2)9-3/h4-5H,1-3H3
InChIKeyRSMPPOUGDDNPDP-UHFFFAOYSA-N
MW145.16 g/mol
LogP-0.21
Rot. Bonds2

About N-methoxy-N,3-dimethyloxirane-2-carboxamide

N-methoxy-N,3-dimethyloxirane-2-carboxamide (PubChem CID 71435783) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is N-methoxy-N,3-dimethyloxirane-2-carboxamide.

Molecular Properties

Compound NameN-methoxy-N,3-dimethyloxirane-2-carboxamide
PubChem CID71435783
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC NameN-methoxy-N,3-dimethyloxirane-2-carboxamide
SMILESCON(C)C(=O)C1OC1C
InChIInChI=1S/C6H11NO3/c1-4-5(10-4)6(8)7(2)9-3/h4-5H,1-3H3
InChIKeyRSMPPOUGDDNPDP-UHFFFAOYSA-N
XLogP-0.21
TPSA42.07 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-0.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-N,3-dimethyloxirane-2-carboxamide?
The IUPAC name of N-methoxy-N,3-dimethyloxirane-2-carboxamide (CID 71435783) is N-methoxy-N,3-dimethyloxirane-2-carboxamide.
What is the SMILES notation for N-methoxy-N,3-dimethyloxirane-2-carboxamide?
The canonical SMILES for N-methoxy-N,3-dimethyloxirane-2-carboxamide is CON(C)C(=O)C1OC1C.
What is the InChIKey of N-methoxy-N,3-dimethyloxirane-2-carboxamide?
The InChIKey is RSMPPOUGDDNPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-4-5(10-4)6(8)7(2)9-3/h4-5H,1-3H3.
What are the key properties of N-methoxy-N,3-dimethyloxirane-2-carboxamide?
N-methoxy-N,3-dimethyloxirane-2-carboxamide has a molecular weight of 145.16 g/mol, XLogP of -0.21, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N,3-dimethyloxirane-2-carboxamide is sourced from PubChem (CID 71435783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).