4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide

C14H20N4OS2 — CID 116664041

IUPAC4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide
SMILESCC(C)C(NC(=O)c1sc(N(C)C)nc1N)c1cccs1
InChIInChI=1S/C14H20N4OS2/c1-8(2)10(9-6-5-7-20-9)16-13(19)11-12(15)17-14(21-11)18(3)4/h5-8,10H,15H2,1-4H3,(H,16,19)
InChIKeyFESSUZIRBQKHIU-UHFFFAOYSA-N
MW324.48 g/mol
LogP2.98
Rot. Bonds5

About 4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide

4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide (PubChem CID 116664041) has the molecular formula C14H20N4OS2 and a molecular weight of 324.48 g/mol. Its IUPAC name is 4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide
PubChem CID116664041
Molecular FormulaC14H20N4OS2
Molecular Weight324.48 g/mol
Exact Mass324.11
IUPAC Name4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide
SMILESCC(C)C(NC(=O)c1sc(N(C)C)nc1N)c1cccs1
InChIInChI=1S/C14H20N4OS2/c1-8(2)10(9-6-5-7-20-9)16-13(19)11-12(15)17-14(21-11)18(3)4/h5-8,10H,15H2,1-4H3,(H,16,19)
InChIKeyFESSUZIRBQKHIU-UHFFFAOYSA-N
XLogP2.98
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.48
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)-2-(dimethylamino)-1,3-thiazole-5-carboxamide
CID 106347696
4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide
CID 116666930
1,3-bis(2-methyl-1-thiophen-2-ylpropyl)urea
CID 47023834
2-tert-butyl-N-(2-methyl-1-thiophen-2-ylpropyl)pyrimidine-5-carboxamide
CID 46964063
2-methylsulfanyl-N-[(1R)-2-methyl-1-thiophen-2-ylpropyl]pyrimidine-5-carboxamide
CID 51498500
4-amino-N-[(3-bromophenyl)methyl]-2-(dimethylamino)-1,3-thiazole-5-carboxamide
CID 116663116
2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)butanamide
CID 43709179
(2S)-2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)butanamide
CID 79024579
4-fluoro-N-[(1R)-2-methyl-1-thiophen-2-ylpropyl]benzamide
CID 9051637
4-amino-N-(3-chloro-2-fluorophenyl)-2-(dimethylamino)-1,3-thiazole-5-carboxamide
CID 116669218
1,1-diethyl-3-(2-methyl-1-thiophen-2-ylpropyl)urea
CID 115575874
2-(4-aminophenyl)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide
CID 43709161

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide (CID 116664041) is 4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide is CC(C)C(NC(=O)c1sc(N(C)C)nc1N)c1cccs1.
What is the InChIKey of 4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide?
The InChIKey is FESSUZIRBQKHIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4OS2/c1-8(2)10(9-6-5-7-20-9)16-13(19)11-12(15)17-14(21-11)18(3)4/h5-8,10H,15H2,1-4H3,(H,16,19).
What are the key properties of 4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide?
4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide has a molecular weight of 324.48 g/mol, XLogP of 2.98, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 116664041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).