[6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine

C16H18N4S — CID 63551420

IUPAC[6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
SMILESCC1Cc2ccccc2N(c2nc3sccn3c2CN)C1
InChIInChI=1S/C16H18N4S/c1-11-8-12-4-2-3-5-13(12)20(10-11)15-14(9-17)19-6-7-21-16(19)18-15/h2-7,11H,8-10,17H2,1H3
InChIKeyQLLZKGDXTBBXSB-UHFFFAOYSA-N
MW298.41 g/mol
LogP3.18
Rot. Bonds2

About [6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine

[6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine (PubChem CID 63551420) has the molecular formula C16H18N4S and a molecular weight of 298.41 g/mol. Its IUPAC name is [6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine.

Molecular Properties

Compound Name[6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
PubChem CID63551420
Molecular FormulaC16H18N4S
Molecular Weight298.41 g/mol
Exact Mass298.13
IUPAC Name[6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
SMILESCC1Cc2ccccc2N(c2nc3sccn3c2CN)C1
InChIInChI=1S/C16H18N4S/c1-11-8-12-4-2-3-5-13(12)20(10-11)15-14(9-17)19-6-7-21-16(19)18-15/h2-7,11H,8-10,17H2,1H3
InChIKeyQLLZKGDXTBBXSB-UHFFFAOYSA-N
XLogP3.18
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]-3-methylpiperidin-4-ol
CID 114679350
4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]-3-methylpiperazine-2,6-dione
CID 66063544
5-(bromomethyl)-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazole
CID 107079123
[5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine
CID 63551419
[2-(aminomethyl)-1,3-thiazol-4-yl]-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 66381388
5-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine
CID 63404154
[6-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 66370348
[6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 61421693
(6-thiomorpholin-4-ylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine
CID 43476395
3-methyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)aniline
CID 115550530
1-(6-chloro-2-pyridinyl)-3-methyl-3,4-dihydro-2H-quinoline
CID 63587479
1-[1-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
CID 55128569

Frequently Asked Questions

What is the IUPAC name of [6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The IUPAC name of [6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine (CID 63551420) is [6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine.
What is the SMILES notation for [6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The canonical SMILES for [6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine is CC1Cc2ccccc2N(c2nc3sccn3c2CN)C1.
What is the InChIKey of [6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The InChIKey is QLLZKGDXTBBXSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4S/c1-11-8-12-4-2-3-5-13(12)20(10-11)15-14(9-17)19-6-7-21-16(19)18-15/h2-7,11H,8-10,17H2,1H3.
What are the key properties of [6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
[6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine has a molecular weight of 298.41 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine is sourced from PubChem (CID 63551420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).