N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide

C11H16N2O2S — CID 71932251

IUPACN-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide
SMILESCCc1nc(CNC(=O)C2CCCO2)cs1
InChIInChI=1S/C11H16N2O2S/c1-2-10-13-8(7-16-10)6-12-11(14)9-4-3-5-15-9/h7,9H,2-6H2,1H3,(H,12,14)
InChIKeyGVVWTYANEYRRMP-UHFFFAOYSA-N
MW240.33 g/mol
LogP1.50
Rot. Bonds4

About N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide

N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide (PubChem CID 71932251) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide
PubChem CID71932251
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC NameN-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide
SMILESCCc1nc(CNC(=O)C2CCCO2)cs1
InChIInChI=1S/C11H16N2O2S/c1-2-10-13-8(7-16-10)6-12-11(14)9-4-3-5-15-9/h7,9H,2-6H2,1H3,(H,12,14)
InChIKeyGVVWTYANEYRRMP-UHFFFAOYSA-N
XLogP1.50
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide?
The IUPAC name of N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide (CID 71932251) is N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide?
The canonical SMILES for N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide is CCc1nc(CNC(=O)C2CCCO2)cs1.
What is the InChIKey of N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide?
The InChIKey is GVVWTYANEYRRMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c1-2-10-13-8(7-16-10)6-12-11(14)9-4-3-5-15-9/h7,9H,2-6H2,1H3,(H,12,14).
What are the key properties of N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide?
N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide has a molecular weight of 240.33 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethyl-1,3-thiazol-4-yl)methyl]oxolane-2-carboxamide is sourced from PubChem (CID 71932251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).