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

C12H14N4S2 — CID 43528430

IUPAC5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine
SMILESCN(Cc1ccsc1)c1nc2sccn2c1CN
InChIInChI=1S/C12H14N4S2/c1-15(7-9-2-4-17-8-9)11-10(6-13)16-3-5-18-12(16)14-11/h2-5,8H,6-7,13H2,1H3
InChIKeyVRFPRKBDBFHFOT-UHFFFAOYSA-N
MW278.41 g/mol
LogP2.55
Rot. Bonds4

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

5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine (PubChem CID 43528430) has the molecular formula C12H14N4S2 and a molecular weight of 278.41 g/mol. Its IUPAC name is 5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine
PubChem CID43528430
Molecular FormulaC12H14N4S2
Molecular Weight278.41 g/mol
Exact Mass278.07
IUPAC Name5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine
SMILESCN(Cc1ccsc1)c1nc2sccn2c1CN
InChIInChI=1S/C12H14N4S2/c1-15(7-9-2-4-17-8-9)11-10(6-13)16-3-5-18-12(16)14-11/h2-5,8H,6-7,13H2,1H3
InChIKeyVRFPRKBDBFHFOT-UHFFFAOYSA-N
XLogP2.55
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.41
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(aminomethyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 43564433
6-[methyl(thiophen-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 43528349
3-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridin-2-amine
CID 43528424
5-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 60892756
5-(2-aminoethyl)-N-[(4-bromophenyl)methyl]-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63786892
5-(aminomethyl)-N,N-dipropylimidazo[2,1-b][1,3]thiazol-6-amine
CID 43476275
5-(chloromethyl)-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 61418071
5-(2-aminopropyl)-N-methyl-N-(pyridin-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 63786996
[6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 43563571
5-(aminomethyl)-N-methyl-N-(oxan-4-yl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 43611472
N-[(3-chlorophenyl)methyl]-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 61416879
N-[(3-bromophenyl)methyl]-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 61415968

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The IUPAC name of 5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine (CID 43528430) is 5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine.
What is the SMILES notation for 5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The canonical SMILES for 5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine is CN(Cc1ccsc1)c1nc2sccn2c1CN.
What is the InChIKey of 5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The InChIKey is VRFPRKBDBFHFOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4S2/c1-15(7-9-2-4-17-8-9)11-10(6-13)16-3-5-18-12(16)14-11/h2-5,8H,6-7,13H2,1H3.
What are the key properties of 5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine has a molecular weight of 278.41 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine is sourced from PubChem (CID 43528430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).