N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine

C13H16N4OS — CID 61422803

IUPACN-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine
SMILESCNCc1c(N(C)Cc2ccoc2)nc2sccn12
InChIInChI=1S/C13H16N4OS/c1-14-7-11-12(15-13-17(11)4-6-19-13)16(2)8-10-3-5-18-9-10/h3-6,9,14H,7-8H2,1-2H3
InChIKeyXTCCCDICHQSHMS-UHFFFAOYSA-N
MW276.37 g/mol
LogP2.34
Rot. Bonds5

About N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine

N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine (PubChem CID 61422803) has the molecular formula C13H16N4OS and a molecular weight of 276.37 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine
PubChem CID61422803
Molecular FormulaC13H16N4OS
Molecular Weight276.37 g/mol
Exact Mass276.10
IUPAC NameN-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine
SMILESCNCc1c(N(C)Cc2ccoc2)nc2sccn12
InChIInChI=1S/C13H16N4OS/c1-14-7-11-12(15-13-17(11)4-6-19-13)16(2)8-10-3-5-18-9-10/h3-6,9,14H,7-8H2,1-2H3
InChIKeyXTCCCDICHQSHMS-UHFFFAOYSA-N
XLogP2.34
TPSA45.71 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.37
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[5-[1-(difluoromethyl)imidazol-2-yl]-4-methyl-1,3-thiazol-2-yl]furan-3-carboxamide
CID 32280157
N-(furan-3-ylmethyl)-N-[(3-methylimidazol-4-yl)methyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine
CID 167940114
2-[[2-(furan-3-yl)-1H-imidazol-5-yl]methyl]-1,3-thiazole
CID 139697875
1-[4-(Furan-3-carbonyl)piperazin-1-yl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone
CID 32531646
N-[1-(furan-3-carbonyl)piperidin-4-yl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 38198746
2-(furan-2-yl)-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 43776452
N-(furan-3-ylmethyl)-5-nitroimidazo[2,1-b][1,3]thiazol-6-amine
CID 47282273
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-methylfuran-3-carboxamide
CID 52563408
1-(6-{[(2R*,6S*)-2,6-dimethylmorpholin-4-yl]carbonyl}imidazo[2,1-b][1,3]thiazol-5-yl)-N-(3-furylmethyl)-N-methylmethanamine
CID 56868517
2-(Furan-3-yl)-4-[(1-methylimidazol-2-yl)sulfanylmethyl]-1,3-thiazole
CID 60277122
6-[Furan-3-ylmethyl(methyl)amino]imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 61422494
6-[Furan-3-ylmethyl(methyl)amino]imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 61422646

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The IUPAC name of N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine (CID 61422803) is N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine.
What is the SMILES notation for N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The canonical SMILES for N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine is CNCc1c(N(C)Cc2ccoc2)nc2sccn12.
What is the InChIKey of N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The InChIKey is XTCCCDICHQSHMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4OS/c1-14-7-11-12(15-13-17(11)4-6-19-13)16(2)8-10-3-5-18-9-10/h3-6,9,14H,7-8H2,1-2H3.
What are the key properties of N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine has a molecular weight of 276.37 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine is sourced from PubChem (CID 61422803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).