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

C6H10N2OS — CID 43392072

IUPAC1-(1,3-thiazol-2-ylamino)propan-2-ol
SMILESCC(O)CNc1nccs1
InChIInChI=1S/C6H10N2OS/c1-5(9)4-8-6-7-2-3-10-6/h2-3,5,9H,4H2,1H3,(H,7,8)
InChIKeyWWXOUXZIKQCVLD-UHFFFAOYSA-N
MW158.23 g/mol
LogP0.94
Rot. Bonds3

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

1-(1,3-thiazol-2-ylamino)propan-2-ol (PubChem CID 43392072) has the molecular formula C6H10N2OS and a molecular weight of 158.23 g/mol. Its IUPAC name is 1-(1,3-thiazol-2-ylamino)propan-2-ol.

Molecular Properties

Compound Name1-(1,3-thiazol-2-ylamino)propan-2-ol
PubChem CID43392072
Molecular FormulaC6H10N2OS
Molecular Weight158.23 g/mol
Exact Mass158.05
IUPAC Name1-(1,3-thiazol-2-ylamino)propan-2-ol
SMILESCC(O)CNc1nccs1
InChIInChI=1S/C6H10N2OS/c1-5(9)4-8-6-7-2-3-10-6/h2-3,5,9H,4H2,1H3,(H,7,8)
InChIKeyWWXOUXZIKQCVLD-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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Related Compounds

N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 4711878
N-(2-chloropropyl)-1,3-thiazol-2-amine
CID 65027252
2-N-methyl-1-N-(1,3-thiazol-2-yl)propane-1,2-diamine
CID 130505496
2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide
CID 106170836
N-(2-cyclopropylpropyl)-1,3-thiazol-2-amine
CID 115591460
3-ethyl-1-N-(1,3-thiazol-2-yl)pentane-1,2-diamine
CID 106287080
2,6-dimethyl-4-[1-(1,3-thiazol-2-ylamino)propan-2-yl]phenol
CID 59073559
N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine
CID 112727052
N'-propan-2-yl-N-(1,3-thiazol-2-yl)ethane-1,2-diamine
CID 20786153
1-(1,3-thiazol-2-ylmethylamino)propan-2-ol;dihydrochloride
CID 56773666
2-(1,3-thiazol-2-ylamino)ethanethiol
CID 88739405
N-(5-methylhexyl)-1,3-thiazol-2-amine
CID 115326150

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-thiazol-2-ylamino)propan-2-ol?
The IUPAC name of 1-(1,3-thiazol-2-ylamino)propan-2-ol (CID 43392072) is 1-(1,3-thiazol-2-ylamino)propan-2-ol.
What is the SMILES notation for 1-(1,3-thiazol-2-ylamino)propan-2-ol?
The canonical SMILES for 1-(1,3-thiazol-2-ylamino)propan-2-ol is CC(O)CNc1nccs1.
What is the InChIKey of 1-(1,3-thiazol-2-ylamino)propan-2-ol?
The InChIKey is WWXOUXZIKQCVLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2OS/c1-5(9)4-8-6-7-2-3-10-6/h2-3,5,9H,4H2,1H3,(H,7,8).
What are the key properties of 1-(1,3-thiazol-2-ylamino)propan-2-ol?
1-(1,3-thiazol-2-ylamino)propan-2-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 1-(1,3-thiazol-2-ylamino)propan-2-ol is sourced from PubChem (CID 43392072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).