1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol

C6H11N3OS — CID 102767603

IUPAC1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol
SMILESCC(O)CNc1ncc(N)s1
InChIInChI=1S/C6H11N3OS/c1-4(10)2-8-6-9-3-5(7)11-6/h3-4,10H,2,7H2,1H3,(H,8,9)
InChIKeyZQJOWUUIPAALIX-UHFFFAOYSA-N
MW173.24 g/mol
LogP0.52
Rot. Bonds3

About 1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol

1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol (PubChem CID 102767603) has the molecular formula C6H11N3OS and a molecular weight of 173.24 g/mol. Its IUPAC name is 1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol.

Molecular Properties

Compound Name1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol
PubChem CID102767603
Molecular FormulaC6H11N3OS
Molecular Weight173.24 g/mol
Exact Mass173.06
IUPAC Name1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol
SMILESCC(O)CNc1ncc(N)s1
InChIInChI=1S/C6H11N3OS/c1-4(10)2-8-6-9-3-5(7)11-6/h3-4,10H,2,7H2,1H3,(H,8,9)
InChIKeyZQJOWUUIPAALIX-UHFFFAOYSA-N
XLogP0.52
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.24
LogP ≤ 50.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-(2-methyl-3-methylsulfanylpropyl)-1,3-thiazole-2,5-diamine
CID 102768509
1-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]propan-2-ol
CID 130617285
2-[(5-amino-1,3-thiazol-2-yl)amino]-N-propan-2-ylacetamide
CID 102767648
2-[(5-amino-1,3-thiazol-2-yl)amino]propan-1-ol
CID 102767605
3-[(5-amino-1,3-thiazol-2-yl)amino]propan-1-ol
CID 87787723
2-N-[4-(dimethylamino)butyl]-1,3-thiazole-2,5-diamine
CID 102768195
1-(1,3-thiazol-2-ylamino)propan-2-ol
CID 43392072
2-N-(3-ethylpentan-2-yl)-1,3-thiazole-2,5-diamine
CID 102768492
3-[(5-amino-1,3-thiazol-2-yl)amino]propanamide
CID 102767632
2-[(5-amino-1,3-thiazol-2-yl)amino]-2-methylbutan-1-ol
CID 102768566
2-N-[(E)-pent-3-enyl]-1,3-thiazole-2,5-diamine
CID 102769013
2-N-(2-methylsulfinylethyl)-1,3-thiazole-2,5-diamine
CID 102769037

Frequently Asked Questions

What is the IUPAC name of 1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol?
The IUPAC name of 1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol (CID 102767603) is 1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol.
What is the SMILES notation for 1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol?
The canonical SMILES for 1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol is CC(O)CNc1ncc(N)s1.
What is the InChIKey of 1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol?
The InChIKey is ZQJOWUUIPAALIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3OS/c1-4(10)2-8-6-9-3-5(7)11-6/h3-4,10H,2,7H2,1H3,(H,8,9).
What are the key properties of 1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol?
1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol has a molecular weight of 173.24 g/mol, XLogP of 0.52, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-amino-1,3-thiazol-2-yl)amino]propan-2-ol is sourced from PubChem (CID 102767603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).