4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide

C14H20N4OS2 — CID 116663361

IUPAC4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide
SMILESCCN(Cc1cccs1)C(=O)c1sc(N(C)CC)nc1N
InChIInChI=1S/C14H20N4OS2/c1-4-17(3)14-16-12(15)11(21-14)13(19)18(5-2)9-10-7-6-8-20-10/h6-8H,4-5,9,15H2,1-3H3
InChIKeyMLJSPANZTUIBHF-UHFFFAOYSA-N
MW324.47 g/mol
LogP2.91
Rot. Bonds6

About 4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide

4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide (PubChem CID 116663361) has the molecular formula C14H20N4OS2 and a molecular weight of 324.47 g/mol. Its IUPAC name is 4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide
PubChem CID116663361
Molecular FormulaC14H20N4OS2
Molecular Weight324.47 g/mol
Exact Mass324.11
IUPAC Name4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide
SMILESCCN(Cc1cccs1)C(=O)c1sc(N(C)CC)nc1N
InChIInChI=1S/C14H20N4OS2/c1-4-17(3)14-16-12(15)11(21-14)13(19)18(5-2)9-10-7-6-8-20-10/h6-8H,4-5,9,15H2,1-3H3
InChIKeyMLJSPANZTUIBHF-UHFFFAOYSA-N
XLogP2.91
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.47
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(furan-2-ylmethyl)-1,3-thiazole-5-carboxamide
CID 116663180
4-amino-N-cyclopropyl-2-(dimethylamino)-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide
CID 116663483
4-amino-N-[2-(dimethylamino)ethyl]-2-[ethyl(methyl)amino]-N-propyl-1,3-thiazole-5-carboxamide
CID 116665037
4-amino-2-[ethyl(methyl)amino]-N-methyl-N-phenyl-1,3-thiazole-5-carboxamide
CID 116667777
4-amino-N-(2-amino-2-oxoethyl)-N-butyl-2-[ethyl(methyl)amino]-1,3-thiazole-5-carboxamide
CID 116664442
N-ethyl-3-pyrrol-1-yl-N-(thiophen-2-ylmethyl)thiophene-2-carboxamide
CID 112810405
6-[ethyl(thiophen-2-ylmethyl)carbamoyl]pyridine-2-carboxylic acid
CID 61437390
N-ethyl-4-fluoro-N-(thiophen-2-ylmethyl)benzamide
CID 60655445
3-amino-N-ethyl-N-(thiophen-2-ylmethyl)benzamide
CID 60940215
4-amino-N-butan-2-yl-N-ethyl-2-[ethyl(methyl)amino]-1,3-thiazole-5-carboxamide
CID 116669640
1,3-diethyl-1-methyl-3-(thiophen-2-ylmethyl)urea
CID 116654591
3-amino-4-(dimethylamino)-N-ethyl-N-(thiophen-2-ylmethyl)benzamide
CID 61106292

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide (CID 116663361) is 4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide is CCN(Cc1cccs1)C(=O)c1sc(N(C)CC)nc1N.
What is the InChIKey of 4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide?
The InChIKey is MLJSPANZTUIBHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4OS2/c1-4-17(3)14-16-12(15)11(21-14)13(19)18(5-2)9-10-7-6-8-20-10/h6-8H,4-5,9,15H2,1-3H3.
What are the key properties of 4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide?
4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide has a molecular weight of 324.47 g/mol, XLogP of 2.91, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-2-[ethyl(methyl)amino]-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 116663361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).