N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide

C10H14N2O2S — CID 3602512

IUPACN-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide
SMILESCN(Cc1nccs1)C(=O)C1CCCO1
InChIInChI=1S/C10H14N2O2S/c1-12(7-9-11-4-6-15-9)10(13)8-3-2-5-14-8/h4,6,8H,2-3,5,7H2,1H3
InChIKeyJRLUTQXNLZTGBS-UHFFFAOYSA-N
MW226.30 g/mol
LogP1.28
Rot. Bonds3

About N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide

N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide (PubChem CID 3602512) has the molecular formula C10H14N2O2S and a molecular weight of 226.30 g/mol. Its IUPAC name is N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide
PubChem CID3602512
Molecular FormulaC10H14N2O2S
Molecular Weight226.30 g/mol
Exact Mass226.08
IUPAC NameN-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide
SMILESCN(Cc1nccs1)C(=O)C1CCCO1
InChIInChI=1S/C10H14N2O2S/c1-12(7-9-11-4-6-15-9)10(13)8-3-2-5-14-8/h4,6,8H,2-3,5,7H2,1H3
InChIKeyJRLUTQXNLZTGBS-UHFFFAOYSA-N
XLogP1.28
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide?
The IUPAC name of N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide (CID 3602512) is N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide.
What is the SMILES notation for N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide?
The canonical SMILES for N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide is CN(Cc1nccs1)C(=O)C1CCCO1.
What is the InChIKey of N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide?
The InChIKey is JRLUTQXNLZTGBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2S/c1-12(7-9-11-4-6-15-9)10(13)8-3-2-5-14-8/h4,6,8H,2-3,5,7H2,1H3.
What are the key properties of N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide?
N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide has a molecular weight of 226.30 g/mol, XLogP of 1.28, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1,3-thiazol-2-ylmethyl)oxolane-2-carboxamide is sourced from PubChem (CID 3602512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).