(2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide

C12H12N2O2S — CID 127834130

IUPAC(2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide
SMILESO=C(Nc1nccc2sccc12)[C@@H]1CCCO1
InChIInChI=1S/C12H12N2O2S/c15-12(9-2-1-6-16-9)14-11-8-4-7-17-10(8)3-5-13-11/h3-5,7,9H,1-2,6H2,(H,13,14,15)/t9-/m0/s1
InChIKeyHZWZJGMPQHGECY-VIFPVBQESA-N
MW248.31 g/mol
LogP2.41
Rot. Bonds2

About (2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide

(2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide (PubChem CID 127834130) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is (2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide
PubChem CID127834130
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC Name(2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide
SMILESO=C(Nc1nccc2sccc12)[C@@H]1CCCO1
InChIInChI=1S/C12H12N2O2S/c15-12(9-2-1-6-16-9)14-11-8-4-7-17-10(8)3-5-13-11/h3-5,7,9H,1-2,6H2,(H,13,14,15)/t9-/m0/s1
InChIKeyHZWZJGMPQHGECY-VIFPVBQESA-N
XLogP2.41
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide?
The IUPAC name of (2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide (CID 127834130) is (2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide.
What is the SMILES notation for (2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide?
The canonical SMILES for (2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide is O=C(Nc1nccc2sccc12)[C@@H]1CCCO1.
What is the InChIKey of (2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide?
The InChIKey is HZWZJGMPQHGECY-VIFPVBQESA-N. The full InChI is InChI=1S/C12H12N2O2S/c15-12(9-2-1-6-16-9)14-11-8-4-7-17-10(8)3-5-13-11/h3-5,7,9H,1-2,6H2,(H,13,14,15)/t9-/m0/s1.
What are the key properties of (2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide?
(2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide has a molecular weight of 248.31 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-thieno[3,2-c]pyridin-4-yloxolane-2-carboxamide is sourced from PubChem (CID 127834130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).