2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide

C8H13N3O2S — CID 106171868

IUPAC2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide
SMILESCC(NCC(O)C(N)=O)c1nccs1
InChIInChI=1S/C8H13N3O2S/c1-5(8-10-2-3-14-8)11-4-6(12)7(9)13/h2-3,5-6,11-12H,4H2,1H3,(H2,9,13)
InChIKeyUVFSNEKKSYVVGZ-UHFFFAOYSA-N
MW215.28 g/mol
LogP-0.36
Rot. Bonds5

About 2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide

2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide (PubChem CID 106171868) has the molecular formula C8H13N3O2S and a molecular weight of 215.28 g/mol. Its IUPAC name is 2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide.

Molecular Properties

Compound Name2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide
PubChem CID106171868
Molecular FormulaC8H13N3O2S
Molecular Weight215.28 g/mol
Exact Mass215.07
IUPAC Name2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide
SMILESCC(NCC(O)C(N)=O)c1nccs1
InChIInChI=1S/C8H13N3O2S/c1-5(8-10-2-3-14-8)11-4-6(12)7(9)13/h2-3,5-6,11-12H,4H2,1H3,(H2,9,13)
InChIKeyUVFSNEKKSYVVGZ-UHFFFAOYSA-N
XLogP-0.36
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.28
LogP ≤ 5-0.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide
CID 103253585
3-[1-(1,3-thiazol-2-yl)ethylamino]propane-1,2-diol
CID 66174830
3-methyl-1-[1-(1,3-thiazol-2-yl)ethylamino]butan-2-ol
CID 115888511
2-hydroxy-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide
CID 130693463
2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide
CID 106170836
N-[1-(1,3-thiazol-2-yl)ethyl]propan-1-amine
CID 46785149
2-[[1-(1,3-thiazol-2-yl)ethylamino]methyl]prop-2-enoic acid
CID 103253582
2,2-difluoro-3-[1-(1,3-thiazol-2-yl)ethylamino]propan-1-ol
CID 104860632
1-(4-methylphenyl)-N'-[1-(1,3-thiazol-2-yl)ethyl]ethane-1,2-diamine
CID 114172177
(1R)-1-phenyl-3-[1-(1,3-thiazol-2-yl)ethylamino]propan-1-ol
CID 112742116
2-methyl-N-[1-(1,3-thiazol-2-yl)ethyl]propanamide
CID 63613076
2-methyl-N-[(1R)-1-(1,3-thiazol-2-yl)ethyl]propanamide
CID 144903789

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide?
The IUPAC name of 2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide (CID 106171868) is 2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide.
What is the SMILES notation for 2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide?
The canonical SMILES for 2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide is CC(NCC(O)C(N)=O)c1nccs1.
What is the InChIKey of 2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide?
The InChIKey is UVFSNEKKSYVVGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2S/c1-5(8-10-2-3-14-8)11-4-6(12)7(9)13/h2-3,5-6,11-12H,4H2,1H3,(H2,9,13).
What are the key properties of 2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide?
2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide has a molecular weight of 215.28 g/mol, XLogP of -0.36, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide is sourced from PubChem (CID 106171868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).