(4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide

C5H8N6OS — CID 130785387

IUPAC(4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide
SMILESO=C(Nc1nn[nH]n1)[C@H]1CSCN1
InChIInChI=1S/C5H8N6OS/c12-4(3-1-13-2-6-3)7-5-8-10-11-9-5/h3,6H,1-2H2,(H2,7,8,9,10,11,12)/t3-/m1/s1
InChIKeyFGVTWLPAJQWJRE-GSVOUGTGSA-N
MW200.23 g/mol
LogP-1.20
Rot. Bonds2

About (4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide

(4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide (PubChem CID 130785387) has the molecular formula C5H8N6OS and a molecular weight of 200.23 g/mol. Its IUPAC name is (4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name(4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide
PubChem CID130785387
Molecular FormulaC5H8N6OS
Molecular Weight200.23 g/mol
Exact Mass200.05
IUPAC Name(4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide
SMILESO=C(Nc1nn[nH]n1)[C@H]1CSCN1
InChIInChI=1S/C5H8N6OS/c12-4(3-1-13-2-6-3)7-5-8-10-11-9-5/h3,6H,1-2H2,(H2,7,8,9,10,11,12)/t3-/m1/s1
InChIKeyFGVTWLPAJQWJRE-GSVOUGTGSA-N
XLogP-1.20
TPSA95.59 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.23
LogP ≤ 5-1.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of (4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide (CID 130785387) is (4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for (4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for (4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide is O=C(Nc1nn[nH]n1)[C@H]1CSCN1.
What is the InChIKey of (4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is FGVTWLPAJQWJRE-GSVOUGTGSA-N. The full InChI is InChI=1S/C5H8N6OS/c12-4(3-1-13-2-6-3)7-5-8-10-11-9-5/h3,6H,1-2H2,(H2,7,8,9,10,11,12)/t3-/m1/s1.
What are the key properties of (4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide?
(4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 200.23 g/mol, XLogP of -1.20, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-N-(2H-tetrazol-5-yl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 130785387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).