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

C10H23NOS — CID 170089110

IUPAC2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol
SMILESCCCS1(C)CCCN1C(C)(C)O
InChIInChI=1S/C10H23NOS/c1-5-8-13(4)9-6-7-11(13)10(2,3)12/h12H,5-9H2,1-4H3
InChIKeySNWSFQVRCHBZBZ-UHFFFAOYSA-N
MW205.37 g/mol
LogP2.18
Rot. Bonds3

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

2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol (PubChem CID 170089110) has the molecular formula C10H23NOS and a molecular weight of 205.37 g/mol. Its IUPAC name is 2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol
PubChem CID170089110
Molecular FormulaC10H23NOS
Molecular Weight205.37 g/mol
Exact Mass205.15
IUPAC Name2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol
SMILESCCCS1(C)CCCN1C(C)(C)O
InChIInChI=1S/C10H23NOS/c1-5-8-13(4)9-6-7-11(13)10(2,3)12/h12H,5-9H2,1-4H3
InChIKeySNWSFQVRCHBZBZ-UHFFFAOYSA-N
XLogP2.18
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.37
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol?
The IUPAC name of 2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol (CID 170089110) is 2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol.
What is the SMILES notation for 2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol?
The canonical SMILES for 2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol is CCCS1(C)CCCN1C(C)(C)O.
What is the InChIKey of 2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol?
The InChIKey is SNWSFQVRCHBZBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NOS/c1-5-8-13(4)9-6-7-11(13)10(2,3)12/h12H,5-9H2,1-4H3.
What are the key properties of 2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol?
2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol has a molecular weight of 205.37 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-1-propyl-1,2-thiazolidin-2-yl)propan-2-ol is sourced from PubChem (CID 170089110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).