1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine

C15H18N4S — CID 82020609

IUPAC1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine
SMILESCC(C)c1ccc(-c2cn3nc(C(C)N)sc3n2)cc1
InChIInChI=1S/C15H18N4S/c1-9(2)11-4-6-12(7-5-11)13-8-19-15(17-13)20-14(18-19)10(3)16/h4-10H,16H2,1-3H3
InChIKeyIXVPXPSLYNYVCH-UHFFFAOYSA-N
MW286.40 g/mol
LogP3.60
Rot. Bonds3

About 1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine

1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine (PubChem CID 82020609) has the molecular formula C15H18N4S and a molecular weight of 286.40 g/mol. Its IUPAC name is 1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine.

Molecular Properties

Compound Name1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine
PubChem CID82020609
Molecular FormulaC15H18N4S
Molecular Weight286.40 g/mol
Exact Mass286.13
IUPAC Name1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine
SMILESCC(C)c1ccc(-c2cn3nc(C(C)N)sc3n2)cc1
InChIInChI=1S/C15H18N4S/c1-9(2)11-4-6-12(7-5-11)13-8-19-15(17-13)20-14(18-19)10(3)16/h4-10H,16H2,1-3H3
InChIKeyIXVPXPSLYNYVCH-UHFFFAOYSA-N
XLogP3.60
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine;hydrochloride
CID 82020654
1-[6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine;hydrochloride
CID 82020618
1-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)ethanamine;hydrochloride
CID 82020630
2-[1-[4-(2-methylpropyl)phenyl]ethyl]-6-phenylimidazo[2,1-b][1,3,4]thiadiazole
CID 156597738
2-pentan-3-yl-6-(4-propan-2-yloxyphenyl)imidazo[2,1-b][1,3,4]thiadiazole
CID 19209493
6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-amine
CID 82483141
6-(4-nitrophenyl)-2-pentan-3-ylimidazo[2,1-b][1,3,4]thiadiazole
CID 19209503
4-(4-propan-2-ylphenyl)-7-thia-2,5,10-triazatricyclo[6.4.0.02,6]dodeca-1(8),3,5-triene
CID 39200779
(4-methyl-1,4-diazepan-1-yl)-[1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidin-4-yl]methanone
CID 135186598
2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine
CID 28750647
2-ethylsulfanyl-6-(4-propan-2-yloxyphenyl)imidazo[2,1-b][1,3,4]thiadiazole
CID 19209914
6-(4-chlorophenyl)-2-propylimidazo[2,1-b][1,3,4]thiadiazole
CID 19209415

Frequently Asked Questions

What is the IUPAC name of 1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine?
The IUPAC name of 1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine (CID 82020609) is 1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine.
What is the SMILES notation for 1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine?
The canonical SMILES for 1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine is CC(C)c1ccc(-c2cn3nc(C(C)N)sc3n2)cc1.
What is the InChIKey of 1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine?
The InChIKey is IXVPXPSLYNYVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4S/c1-9(2)11-4-6-12(7-5-11)13-8-19-15(17-13)20-14(18-19)10(3)16/h4-10H,16H2,1-3H3.
What are the key properties of 1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine?
1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine has a molecular weight of 286.40 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]ethanamine is sourced from PubChem (CID 82020609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).