2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide

C12H15N3O3S — CID 110004120

IUPAC2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide
SMILESCCNc1ncc(C(=O)NC(CO)c2ccco2)s1
InChIInChI=1S/C12H15N3O3S/c1-2-13-12-14-6-10(19-12)11(17)15-8(7-16)9-4-3-5-18-9/h3-6,8,16H,2,7H2,1H3,(H,13,14)(H,15,17)
InChIKeyRUFVWHYVTIZBBP-UHFFFAOYSA-N
MW281.34 g/mol
LogP1.63
Rot. Bonds6

About 2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide

2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide (PubChem CID 110004120) has the molecular formula C12H15N3O3S and a molecular weight of 281.34 g/mol. Its IUPAC name is 2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide
PubChem CID110004120
Molecular FormulaC12H15N3O3S
Molecular Weight281.34 g/mol
Exact Mass281.08
IUPAC Name2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide
SMILESCCNc1ncc(C(=O)NC(CO)c2ccco2)s1
InChIInChI=1S/C12H15N3O3S/c1-2-13-12-14-6-10(19-12)11(17)15-8(7-16)9-4-3-5-18-9/h3-6,8,16H,2,7H2,1H3,(H,13,14)(H,15,17)
InChIKeyRUFVWHYVTIZBBP-UHFFFAOYSA-N
XLogP1.63
TPSA87.39 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.34
LogP ≤ 51.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

(3R)-3-[[2-(ethylamino)pyrimidine-5-carbonyl]amino]-3-(furan-2-yl)propanoic acid
CID 97195064
2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]-1,3-thiazole-5-carboxamide
CID 75435847
N-[1-(furan-2-yl)-2-hydroxyethyl]-2-methylprop-2-enamide
CID 178173933
N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-2-(ethylamino)-1,3-thiazole-5-carboxamide
CID 75395361
2-(ethylamino)-N-(3-ethyl-2-hydroxypentyl)-1,3-thiazole-5-carboxamide
CID 111664801
N-[1-(furan-2-yl)-2-hydroxyethyl]-2-(pyridin-3-ylmethylamino)benzamide
CID 110004108
2-(ethylamino)-N-[(R)-furan-2-yl(phenyl)methyl]pyrimidine-5-carboxamide
CID 97148730
N-(1-hydroxy-4,4-dimethylpentan-2-yl)-2-(prop-2-enylamino)-1,3-thiazole-5-carboxamide
CID 110004143
2-(ethylamino)-N-(4-hydroxy-3-methylphenyl)-1,3-thiazole-5-carboxamide
CID 75436787
1-(2-chlorophenyl)-N-[(1S)-1-(furan-2-yl)-2-hydroxyethyl]-5-methylpyrazole-3-carboxamide
CID 97337801
[2-(ethylamino)-1,3-thiazol-5-yl]-(2-methylphenyl)methanone;propan-1-amine;hydrochloride
CID 142276499
ethyl (3S)-3-(furan-2-yl)-3-(hydroxyamino)propanoate
CID 125473077

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide (CID 110004120) is 2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide is CCNc1ncc(C(=O)NC(CO)c2ccco2)s1.
What is the InChIKey of 2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide?
The InChIKey is RUFVWHYVTIZBBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O3S/c1-2-13-12-14-6-10(19-12)11(17)15-8(7-16)9-4-3-5-18-9/h3-6,8,16H,2,7H2,1H3,(H,13,14)(H,15,17).
What are the key properties of 2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide?
2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide has a molecular weight of 281.34 g/mol, XLogP of 1.63, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-[1-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 110004120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).