2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol

C7H15NOS — CID 123284658

IUPAC2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol
SMILESCN1CCSC1C(C)(C)O
InChIInChI=1S/C7H15NOS/c1-7(2,9)6-8(3)4-5-10-6/h6,9H,4-5H2,1-3H3
InChIKeySNKPWKWAWZBPEV-UHFFFAOYSA-N
MW161.27 g/mol
LogP0.76
Rot. Bonds1

About 2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol

2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol (PubChem CID 123284658) has the molecular formula C7H15NOS and a molecular weight of 161.27 g/mol. Its IUPAC name is 2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol
PubChem CID123284658
Molecular FormulaC7H15NOS
Molecular Weight161.27 g/mol
Exact Mass161.09
IUPAC Name2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol
SMILESCN1CCSC1C(C)(C)O
InChIInChI=1S/C7H15NOS/c1-7(2,9)6-8(3)4-5-10-6/h6,9H,4-5H2,1-3H3
InChIKeySNKPWKWAWZBPEV-UHFFFAOYSA-N
XLogP0.76
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.27
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2R)-2,3-dimethyl-1,3-thiazolidin-4-yl]propan-2-ol
CID 146613290
2-Methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol
CID 60883838
3-[(Dimethylamino)methyl]thiolan-3-ol
CID 84731513
3-(Diethylaminomethyl)thiolan-3-ol
CID 84732966
1-(3-Ethylsulfanylpropyl)-3-methylpyrrolidin-3-ol
CID 103728379
2-Methyl-1-methylsulfanyl-3-pyrrolidin-1-ylpropan-2-ol
CID 106246318
1-[3-Ethylsulfanylpropyl(methyl)amino]-2-methylpropan-2-ol
CID 115665565
1-[Ethyl(3-ethylsulfanylpropyl)amino]-2-methylpropan-2-ol
CID 115666835
1-(3-Methyl-1,3-thiazolidin-2-yl)ethanol
CID 121305464

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol?
The IUPAC name of 2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol (CID 123284658) is 2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol.
What is the SMILES notation for 2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol?
The canonical SMILES for 2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol is CN1CCSC1C(C)(C)O.
What is the InChIKey of 2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol?
The InChIKey is SNKPWKWAWZBPEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NOS/c1-7(2,9)6-8(3)4-5-10-6/h6,9H,4-5H2,1-3H3.
What are the key properties of 2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol?
2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol has a molecular weight of 161.27 g/mol, XLogP of 0.76, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-1,3-thiazolidin-2-yl)propan-2-ol is sourced from PubChem (CID 123284658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).