2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone

C7H10N2O2S — CID 66568954

IUPAC2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone
SMILESO=C(CNCCO)c1nccs1
InChIInChI=1S/C7H10N2O2S/c10-3-1-8-5-6(11)7-9-2-4-12-7/h2,4,8,10H,1,3,5H2
InChIKeyVFNWNCOOMQTPIG-UHFFFAOYSA-N
MW186.24 g/mol
LogP-0.09
Rot. Bonds5

About 2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone

2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone (PubChem CID 66568954) has the molecular formula C7H10N2O2S and a molecular weight of 186.24 g/mol. Its IUPAC name is 2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone.

Molecular Properties

Compound Name2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone
PubChem CID66568954
Molecular FormulaC7H10N2O2S
Molecular Weight186.24 g/mol
Exact Mass186.05
IUPAC Name2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone
SMILESO=C(CNCCO)c1nccs1
InChIInChI=1S/C7H10N2O2S/c10-3-1-8-5-6(11)7-9-2-4-12-7/h2,4,8,10H,1,3,5H2
InChIKeyVFNWNCOOMQTPIG-UHFFFAOYSA-N
XLogP-0.09
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.24
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-chloro-1-(1,3-thiazol-2-yl)ethanone
CID 22498777
[[2-oxo-2-(1,3-thiazol-2-yl)ethyl]amino]thiourea
CID 170262385
4,4-difluoro-1-(1,3-thiazol-2-yl)butane-1,3-dione
CID 64993249
CID 69459233
CID 69459233
2-[[(3S)-pyrrolidin-3-yl]amino]-1-(1,3-thiazol-2-yl)ethanone
CID 71645013
2-(pyrrolidin-3-ylamino)-1-(1,3-thiazol-2-yl)ethanone;hydrochloride
CID 71645049
2-chloro-N-methyl-N-[2-oxo-2-(1,3-thiazol-2-yl)ethyl]acetamide
CID 66568987
hydroxymethyl 1,3-thiazole-2-carboxylate
CID 145074713
2-[[(3R)-piperidin-3-yl]amino]-1-(1,3-thiazol-2-yl)ethanone;hydrochloride
CID 71644976
2-(piperidin-3-ylamino)-1-(1,3-thiazol-2-yl)ethanone;hydrochloride
CID 71645037
2-[methyl-[2-oxo-2-(1,3-thiazol-2-yl)ethyl]amino]acetic acid
CID 66568664
N-(aminomethyl)-1,3-thiazole-2-carboxamide
CID 123824838

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone?
The IUPAC name of 2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone (CID 66568954) is 2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone.
What is the SMILES notation for 2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone?
The canonical SMILES for 2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone is O=C(CNCCO)c1nccs1.
What is the InChIKey of 2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone?
The InChIKey is VFNWNCOOMQTPIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2S/c10-3-1-8-5-6(11)7-9-2-4-12-7/h2,4,8,10H,1,3,5H2.
What are the key properties of 2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone?
2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone has a molecular weight of 186.24 g/mol, XLogP of -0.09, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethylamino)-1-(1,3-thiazol-2-yl)ethanone is sourced from PubChem (CID 66568954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).