(4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine

C6H9N3S — CID 82416294

IUPAC(4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine
SMILESc1cc([C@H]2CSCN2)[nH]n1
InChIInChI=1S/C6H9N3S/c1-2-8-9-5(1)6-3-10-4-7-6/h1-2,6-7H,3-4H2,(H,8,9)/t6-/m1/s1
InChIKeyYPZRKMYPLVEPOO-ZCFIWIBFSA-N
MW155.23 g/mol
LogP0.74
Rot. Bonds1

About (4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine

(4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine (PubChem CID 82416294) has the molecular formula C6H9N3S and a molecular weight of 155.23 g/mol. Its IUPAC name is (4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine.

Molecular Properties

Compound Name(4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine
PubChem CID82416294
Molecular FormulaC6H9N3S
Molecular Weight155.23 g/mol
Exact Mass155.05
IUPAC Name(4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine
SMILESc1cc([C@H]2CSCN2)[nH]n1
InChIInChI=1S/C6H9N3S/c1-2-8-9-5(1)6-3-10-4-7-6/h1-2,6-7H,3-4H2,(H,8,9)/t6-/m1/s1
InChIKeyYPZRKMYPLVEPOO-ZCFIWIBFSA-N
XLogP0.74
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.23
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2,5-dihydro-1H-pyrrol-2-yl)-1H-pyrazole
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CID 174685317
CID 174685317
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CID 175166149
N-[3-(1H-pyrazol-5-yl)phenyl]-1,3-thiazolidine-4-carboxamide
CID 43711254
5-(9H-fluoren-9-yl)-1H-pyrazole
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telluroxodihydrodiazole
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(5R)-5-(1H-pyrazol-5-yl)-4-azatricyclo[2.2.0.02,6]hexan-3-one
CID 70072159
(2R)-1-cyclopentyl-2-(1H-pyrazol-5-yl)piperidine
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5-[[(3S)-3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]methyl]-1,3-thiazole
CID 125012821
4-[3-(1H-pyrazol-5-yl)piperidin-1-yl]-5,7-dihydrothieno[3,4-d]pyrimidin-2-amine
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cyclopropyl-[3-(1H-pyrazol-5-yl)piperidin-1-yl]methanone
CID 62866717
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CID 141059109

Frequently Asked Questions

What is the IUPAC name of (4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine?
The IUPAC name of (4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine (CID 82416294) is (4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine.
What is the SMILES notation for (4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine?
The canonical SMILES for (4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine is c1cc([C@H]2CSCN2)[nH]n1.
What is the InChIKey of (4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine?
The InChIKey is YPZRKMYPLVEPOO-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H9N3S/c1-2-8-9-5(1)6-3-10-4-7-6/h1-2,6-7H,3-4H2,(H,8,9)/t6-/m1/s1.
What are the key properties of (4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine?
(4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine has a molecular weight of 155.23 g/mol, XLogP of 0.74, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-(1H-pyrazol-5-yl)-1,3-thiazolidine is sourced from PubChem (CID 82416294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).