2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide

C6H9N3O2S — CID 106170836

IUPAC2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide
SMILESNC(=O)C(O)CNc1nccs1
InChIInChI=1S/C6H9N3O2S/c7-5(11)4(10)3-9-6-8-1-2-12-6/h1-2,4,10H,3H2,(H2,7,11)(H,8,9)
InChIKeyWHGAFXDIDCUWTC-UHFFFAOYSA-N
MW187.22 g/mol
LogP-0.60
Rot. Bonds4

About 2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide

2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide (PubChem CID 106170836) has the molecular formula C6H9N3O2S and a molecular weight of 187.22 g/mol. Its IUPAC name is 2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide.

Molecular Properties

Compound Name2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide
PubChem CID106170836
Molecular FormulaC6H9N3O2S
Molecular Weight187.22 g/mol
Exact Mass187.04
IUPAC Name2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide
SMILESNC(=O)C(O)CNc1nccs1
InChIInChI=1S/C6H9N3O2S/c7-5(11)4(10)3-9-6-8-1-2-12-6/h1-2,4,10H,3H2,(H2,7,11)(H,8,9)
InChIKeyWHGAFXDIDCUWTC-UHFFFAOYSA-N
XLogP-0.60
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.22
LogP ≤ 5-0.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1,3-thiazol-2-ylamino)propan-2-ol
CID 43392072
2-hydroxy-3-[1-(1,3-thiazol-2-yl)ethylamino]propanamide
CID 106171868
N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 4711878
N-(2-chloropropyl)-1,3-thiazol-2-amine
CID 65027252
3-ethyl-1-N-(1,3-thiazol-2-yl)pentane-1,2-diamine
CID 106287080
1,3-thiazol-2-ylurea;hydrochloride
CID 118455578
2-N-methyl-1-N-(1,3-thiazol-2-yl)propane-1,2-diamine
CID 130505496
methyl 3-(1,3-thiazol-2-ylamino)propanoate
CID 60658875
N-butan-2-yl-2-(1,3-thiazol-2-ylamino)acetamide
CID 110693984
2-(1,3-thiazol-2-ylamino)acetaldehyde
CID 76551851
N-(2-chloro-2-cyclopropylethyl)-1,3-thiazol-2-amine
CID 65033764
N-ethyl-2-(1,3-thiazol-2-ylamino)acetamide
CID 43399053

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide?
The IUPAC name of 2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide (CID 106170836) is 2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide.
What is the SMILES notation for 2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide?
The canonical SMILES for 2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide is NC(=O)C(O)CNc1nccs1.
What is the InChIKey of 2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide?
The InChIKey is WHGAFXDIDCUWTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2S/c7-5(11)4(10)3-9-6-8-1-2-12-6/h1-2,4,10H,3H2,(H2,7,11)(H,8,9).
What are the key properties of 2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide?
2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide has a molecular weight of 187.22 g/mol, XLogP of -0.60, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-(1,3-thiazol-2-ylamino)propanamide is sourced from PubChem (CID 106170836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).