2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide

C12H20N4O2S — CID 117082667

IUPAC2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide
SMILESCCNc1ncc(C(=O)NCCN2CCOCC2)s1
InChIInChI=1S/C12H20N4O2S/c1-2-13-12-15-9-10(19-12)11(17)14-3-4-16-5-7-18-8-6-16/h9H,2-8H2,1H3,(H,13,15)(H,14,17)
InChIKeyNXODSOQCJLNVMX-UHFFFAOYSA-N
MW284.38 g/mol
LogP0.64
Rot. Bonds6

About 2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide

2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide (PubChem CID 117082667) has the molecular formula C12H20N4O2S and a molecular weight of 284.38 g/mol. Its IUPAC name is 2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide
PubChem CID117082667
Molecular FormulaC12H20N4O2S
Molecular Weight284.38 g/mol
Exact Mass284.13
IUPAC Name2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide
SMILESCCNc1ncc(C(=O)NCCN2CCOCC2)s1
InChIInChI=1S/C12H20N4O2S/c1-2-13-12-15-9-10(19-12)11(17)14-3-4-16-5-7-18-8-6-16/h9H,2-8H2,1H3,(H,13,15)(H,14,17)
InChIKeyNXODSOQCJLNVMX-UHFFFAOYSA-N
XLogP0.64
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide
CID 11558091
2-(4-Methyl-piperazin-1-yl)-thiazole-5-carboxylic acid hydroxyamide
CID 11572286
N-[5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]acetamide
CID 686432
N-(5-(piperazin-1-ylmethyl)thiazol-2-yl)acetamide
CID 60175141
[2-(Ethylamino)-1,3-thiazol-5-yl]-piperidin-1-ylmethanone
CID 97236851
4-[(2-Amino-1,3-thiazol-5-yl)carbonyl]-1-butylpiperazin-2-one
CID 124215181
2-amino-N-methyl-N-(4-morpholin-4-ylbutyl)-1,3-thiazole-5-carboxamide
CID 124218298
(2-amino-1,3-thiazol-5-yl)-[(3S)-3-methyl-4-propan-2-ylpiperazin-1-yl]methanone
CID 125525751
N-cycloheptyl-2-(2-morpholin-4-ylethylamino)-1,3-thiazole-5-carboxamide
CID 139263977
1-(4-Acetylpiperazin-1-yl)-3-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]propan-1-one
CID 133508858
1-Morpholin-4-yl-3-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]propan-1-one
CID 133522370
2-(2-morpholin-4-ylethylamino)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1,3-thiazole-5-carboxamide
CID 117080482

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide (CID 117082667) is 2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide is CCNc1ncc(C(=O)NCCN2CCOCC2)s1.
What is the InChIKey of 2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide?
The InChIKey is NXODSOQCJLNVMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2S/c1-2-13-12-15-9-10(19-12)11(17)14-3-4-16-5-7-18-8-6-16/h9H,2-8H2,1H3,(H,13,15)(H,14,17).
What are the key properties of 2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide?
2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide has a molecular weight of 284.38 g/mol, XLogP of 0.64, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 117082667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).