5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide

C11H16N2O2S — CID 75506194

IUPAC5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide
SMILESC=CCN(CCO)C(=O)c1ncc(CC)s1
InChIInChI=1S/C11H16N2O2S/c1-3-5-13(6-7-14)11(15)10-12-8-9(4-2)16-10/h3,8,14H,1,4-7H2,2H3
InChIKeySADUWQIHAQAMLW-UHFFFAOYSA-N
MW240.33 g/mol
LogP1.33
Rot. Bonds6

About 5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide

5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide (PubChem CID 75506194) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is 5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide
PubChem CID75506194
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC Name5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide
SMILESC=CCN(CCO)C(=O)c1ncc(CC)s1
InChIInChI=1S/C11H16N2O2S/c1-3-5-13(6-7-14)11(15)10-12-8-9(4-2)16-10/h3,8,14H,1,4-7H2,2H3
InChIKeySADUWQIHAQAMLW-UHFFFAOYSA-N
XLogP1.33
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-ethyl-N-(2-hydroxyethyl)-N-prop-2-enylbenzamide
CID 113340627
N-(2-hydroxyethyl)-3,5-dimethyl-N-prop-2-enylbenzamide
CID 113340642
2,5-dichloro-N-(2-hydroxyethyl)-N-prop-2-enylpyridine-4-carboxamide
CID 114918916
5-amino-2-chloro-N-(2-hydroxyethyl)-N-prop-2-enylpyridine-4-carboxamide
CID 114089582
3-fluoro-N-(2-hydroxyethyl)-N-prop-2-enylpyridine-4-carboxamide
CID 115775734
4-(diethylamino)-N-(2-hydroxyethyl)-N-prop-2-enylbenzamide
CID 115924108
N-(2-hydroxyethyl)-N-prop-2-enylacetamide
CID 84572947
2,3,4,5-tetrafluoro-N-(2-hydroxyethyl)-N-prop-2-enylbenzamide
CID 115775854
4-fluoro-N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylbenzamide
CID 115776016
N-(2-hydroxyethyl)-4-iodo-N-prop-2-enylbenzamide
CID 115776140
2,4-dihydroxy-N-(2-hydroxyethyl)-N-prop-2-enylbenzamide
CID 113368377
N-(2-hydroxyethyl)-3,5-dimethoxy-N-prop-2-enylbenzamide
CID 115775572

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide?
The IUPAC name of 5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide (CID 75506194) is 5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide?
The canonical SMILES for 5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide is C=CCN(CCO)C(=O)c1ncc(CC)s1.
What is the InChIKey of 5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide?
The InChIKey is SADUWQIHAQAMLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c1-3-5-13(6-7-14)11(15)10-12-8-9(4-2)16-10/h3,8,14H,1,4-7H2,2H3.
What are the key properties of 5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide?
5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide has a molecular weight of 240.33 g/mol, XLogP of 1.33, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(2-hydroxyethyl)-N-prop-2-enyl-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 75506194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).