4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide

C12H16N4O2S — CID 116663214

IUPAC4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide
SMILESCN(Cc1ccoc1)C(=O)c1sc(N(C)C)nc1N
InChIInChI=1S/C12H16N4O2S/c1-15(2)12-14-10(13)9(19-12)11(17)16(3)6-8-4-5-18-7-8/h4-5,7H,6,13H2,1-3H3
InChIKeyRTOFKCKERWIMPW-UHFFFAOYSA-N
MW280.35 g/mol
LogP1.66
Rot. Bonds4

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

4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide (PubChem CID 116663214) has the molecular formula C12H16N4O2S and a molecular weight of 280.35 g/mol. Its IUPAC name is 4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide
PubChem CID116663214
Molecular FormulaC12H16N4O2S
Molecular Weight280.35 g/mol
Exact Mass280.10
IUPAC Name4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide
SMILESCN(Cc1ccoc1)C(=O)c1sc(N(C)C)nc1N
InChIInChI=1S/C12H16N4O2S/c1-15(2)12-14-10(13)9(19-12)11(17)16(3)6-8-4-5-18-7-8/h4-5,7H,6,13H2,1-3H3
InChIKeyRTOFKCKERWIMPW-UHFFFAOYSA-N
XLogP1.66
TPSA75.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-N-[(4-bromophenyl)methyl]-2-(dimethylamino)-N-methyl-1,3-thiazole-5-carboxamide
CID 116663147
2-amino-N-(furan-3-ylmethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide
CID 62793462
4-amino-2-(dimethylamino)-N-methyl-N-[(3-methylphenyl)methyl]-1,3-thiazole-5-carboxamide
CID 116663126
4-amino-N-[(5-chlorothiophen-2-yl)methyl]-2-(dimethylamino)-N-methyl-1,3-thiazole-5-carboxamide
CID 116663381
4-amino-2-(dimethylamino)-N-methyl-N-prop-2-ynyl-1,3-thiazole-5-carboxamide
CID 116671884
4-amino-2-(dimethylamino)-N-methyl-N-(2-methylbutyl)-1,3-thiazole-5-carboxamide
CID 116669684
5-amino-N-(furan-3-ylmethyl)-N-methyl-1-benzofuran-2-carboxamide
CID 61421765
N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-4-carboxamide
CID 61151195
4-amino-N-[(5-bromothiophen-2-yl)methyl]-2-(dimethylamino)-1,3-thiazole-5-carboxamide
CID 116666832
N-(furan-3-ylmethyl)-N,4-dimethylbenzamide
CID 110868919
4-amino-2-(dimethylamino)-N,N-bis(2-hydroxyethyl)-1,3-thiazole-5-carboxamide
CID 116670876
2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide
CID 106686601

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide (CID 116663214) is 4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide is CN(Cc1ccoc1)C(=O)c1sc(N(C)C)nc1N.
What is the InChIKey of 4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is RTOFKCKERWIMPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O2S/c1-15(2)12-14-10(13)9(19-12)11(17)16(3)6-8-4-5-18-7-8/h4-5,7H,6,13H2,1-3H3.
What are the key properties of 4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide?
4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 280.35 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(dimethylamino)-N-(furan-3-ylmethyl)-N-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 116663214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).