(2-amino-1,3-thiazol-5-yl)methanol

C4H6N2OS — CID 11217273

IUPAC(2-amino-1,3-thiazol-5-yl)methanol
SMILESNc1ncc(CO)s1
InChIInChI=1S/C4H6N2OS/c5-4-6-1-3(2-7)8-4/h1,7H,2H2,(H2,5,6)
InChIKeyTZEMBFLDHOUKNI-UHFFFAOYSA-N
MW130.17 g/mol
LogP0.22
Rot. Bonds1

About (2-amino-1,3-thiazol-5-yl)methanol

(2-amino-1,3-thiazol-5-yl)methanol (PubChem CID 11217273) has the molecular formula C4H6N2OS and a molecular weight of 130.17 g/mol. Its IUPAC name is (2-amino-1,3-thiazol-5-yl)methanol.

Molecular Properties

Compound Name(2-amino-1,3-thiazol-5-yl)methanol
PubChem CID11217273
Molecular FormulaC4H6N2OS
Molecular Weight130.17 g/mol
Exact Mass130.02
IUPAC Name(2-amino-1,3-thiazol-5-yl)methanol
SMILESNc1ncc(CO)s1
InChIInChI=1S/C4H6N2OS/c5-4-6-1-3(2-7)8-4/h1,7H,2H2,(H2,5,6)
InChIKeyTZEMBFLDHOUKNI-UHFFFAOYSA-N
XLogP0.22
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.17
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-amino-1,3-thiazol-5-yl)methanol?
The IUPAC name of (2-amino-1,3-thiazol-5-yl)methanol (CID 11217273) is (2-amino-1,3-thiazol-5-yl)methanol.
What is the SMILES notation for (2-amino-1,3-thiazol-5-yl)methanol?
The canonical SMILES for (2-amino-1,3-thiazol-5-yl)methanol is Nc1ncc(CO)s1.
What is the InChIKey of (2-amino-1,3-thiazol-5-yl)methanol?
The InChIKey is TZEMBFLDHOUKNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2OS/c5-4-6-1-3(2-7)8-4/h1,7H,2H2,(H2,5,6).
What are the key properties of (2-amino-1,3-thiazol-5-yl)methanol?
(2-amino-1,3-thiazol-5-yl)methanol has a molecular weight of 130.17 g/mol, XLogP of 0.22, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-1,3-thiazol-5-yl)methanol is sourced from PubChem (CID 11217273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).