5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine

C15H18N4OS — CID 63786186

IUPAC5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
SMILESCOc1cccc(N(C)c2nc3sccn3c2CCN)c1
InChIInChI=1S/C15H18N4OS/c1-18(11-4-3-5-12(10-11)20-2)14-13(6-7-16)19-8-9-21-15(19)17-14/h3-5,8-10H,6-7,16H2,1-2H3
InChIKeyAKDBNUXJORTXBJ-UHFFFAOYSA-N
MW302.40 g/mol
LogP2.67
Rot. Bonds5

About 5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine

5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine (PubChem CID 63786186) has the molecular formula C15H18N4OS and a molecular weight of 302.40 g/mol. Its IUPAC name is 5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine.

Molecular Properties

Compound Name5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
PubChem CID63786186
Molecular FormulaC15H18N4OS
Molecular Weight302.40 g/mol
Exact Mass302.12
IUPAC Name5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
SMILESCOc1cccc(N(C)c2nc3sccn3c2CCN)c1
InChIInChI=1S/C15H18N4OS/c1-18(11-4-3-5-12(10-11)20-2)14-13(6-7-16)19-8-9-21-15(19)17-14/h3-5,8-10H,6-7,16H2,1-2H3
InChIKeyAKDBNUXJORTXBJ-UHFFFAOYSA-N
XLogP2.67
TPSA55.79 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(2-aminoethyl)-N-(3-fluorophenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63786863
5-(2-aminoethyl)-N-[(4-bromophenyl)methyl]-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63786892
5-(2-aminoethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63785509
5-(2-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 55236778
5-(2-aminoethyl)-N-benzyl-N-ethylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63783393
5-(2-aminoethyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 112666806
5-(chloromethyl)-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 61418071
5-(2-aminopropyl)-N-methyl-N-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 63815102
2-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylaniline
CID 63785861
5-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 63787515
2-[6-(2-bromophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 63815749
2-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-(3-methoxyphenyl)ethanol
CID 111114800

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine?
The IUPAC name of 5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine (CID 63786186) is 5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine.
What is the SMILES notation for 5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine?
The canonical SMILES for 5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine is COc1cccc(N(C)c2nc3sccn3c2CCN)c1.
What is the InChIKey of 5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine?
The InChIKey is AKDBNUXJORTXBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4OS/c1-18(11-4-3-5-12(10-11)20-2)14-13(6-7-16)19-8-9-21-15(19)17-14/h3-5,8-10H,6-7,16H2,1-2H3.
What are the key properties of 5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine?
5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine has a molecular weight of 302.40 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-N-(3-methoxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazol-6-amine is sourced from PubChem (CID 63786186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).