2-(1,3-thiazol-2-ylamino)propan-1-ol

C6H10N2OS — CID 43500313

IUPAC2-(1,3-thiazol-2-ylamino)propan-1-ol
SMILESCC(CO)Nc1nccs1
InChIInChI=1S/C6H10N2OS/c1-5(4-9)8-6-7-2-3-10-6/h2-3,5,9H,4H2,1H3,(H,7,8)
InChIKeyVLFPLNQDWAZURZ-UHFFFAOYSA-N
MW158.23 g/mol
LogP0.94
Rot. Bonds3

About 2-(1,3-thiazol-2-ylamino)propan-1-ol

2-(1,3-thiazol-2-ylamino)propan-1-ol (PubChem CID 43500313) has the molecular formula C6H10N2OS and a molecular weight of 158.23 g/mol. Its IUPAC name is 2-(1,3-thiazol-2-ylamino)propan-1-ol.

Molecular Properties

Compound Name2-(1,3-thiazol-2-ylamino)propan-1-ol
PubChem CID43500313
Molecular FormulaC6H10N2OS
Molecular Weight158.23 g/mol
Exact Mass158.05
IUPAC Name2-(1,3-thiazol-2-ylamino)propan-1-ol
SMILESCC(CO)Nc1nccs1
InChIInChI=1S/C6H10N2OS/c1-5(4-9)8-6-7-2-3-10-6/h2-3,5,9H,4H2,1H3,(H,7,8)
InChIKeyVLFPLNQDWAZURZ-UHFFFAOYSA-N
XLogP0.94
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.23
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazol-2-ylamino)propan-1-ol?
The IUPAC name of 2-(1,3-thiazol-2-ylamino)propan-1-ol (CID 43500313) is 2-(1,3-thiazol-2-ylamino)propan-1-ol.
What is the SMILES notation for 2-(1,3-thiazol-2-ylamino)propan-1-ol?
The canonical SMILES for 2-(1,3-thiazol-2-ylamino)propan-1-ol is CC(CO)Nc1nccs1.
What is the InChIKey of 2-(1,3-thiazol-2-ylamino)propan-1-ol?
The InChIKey is VLFPLNQDWAZURZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2OS/c1-5(4-9)8-6-7-2-3-10-6/h2-3,5,9H,4H2,1H3,(H,7,8).
What are the key properties of 2-(1,3-thiazol-2-ylamino)propan-1-ol?
2-(1,3-thiazol-2-ylamino)propan-1-ol has a molecular weight of 158.23 g/mol, XLogP of 0.94, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazol-2-ylamino)propan-1-ol is sourced from PubChem (CID 43500313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).