2-methyloxolane-3-carboxamide

C6H11NO2 — CID 67260253

IUPAC2-methyloxolane-3-carboxamide
SMILESCC1OCCC1C(N)=O
InChIInChI=1S/C6H11NO2/c1-4-5(6(7)8)2-3-9-4/h4-5H,2-3H2,1H3,(H2,7,8)
InChIKeyLUGMTYBJDKGSPV-UHFFFAOYSA-N
MW129.16 g/mol
LogP-0.10
Rot. Bonds1

About 2-methyloxolane-3-carboxamide

2-methyloxolane-3-carboxamide (PubChem CID 67260253) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is 2-methyloxolane-3-carboxamide.

Molecular Properties

Compound Name2-methyloxolane-3-carboxamide
PubChem CID67260253
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC Name2-methyloxolane-3-carboxamide
SMILESCC1OCCC1C(N)=O
InChIInChI=1S/C6H11NO2/c1-4-5(6(7)8)2-3-9-4/h4-5H,2-3H2,1H3,(H2,7,8)
InChIKeyLUGMTYBJDKGSPV-UHFFFAOYSA-N
XLogP-0.10
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyloxolane-3-carboxamide?
The IUPAC name of 2-methyloxolane-3-carboxamide (CID 67260253) is 2-methyloxolane-3-carboxamide.
What is the SMILES notation for 2-methyloxolane-3-carboxamide?
The canonical SMILES for 2-methyloxolane-3-carboxamide is CC1OCCC1C(N)=O.
What is the InChIKey of 2-methyloxolane-3-carboxamide?
The InChIKey is LUGMTYBJDKGSPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-4-5(6(7)8)2-3-9-4/h4-5H,2-3H2,1H3,(H2,7,8).
What are the key properties of 2-methyloxolane-3-carboxamide?
2-methyloxolane-3-carboxamide has a molecular weight of 129.16 g/mol, XLogP of -0.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyloxolane-3-carboxamide is sourced from PubChem (CID 67260253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).