1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine

C12H16N4S — CID 129473583

IUPAC1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine
SMILESc1cn2c(n1)CC[C@@H](CNCc1cscn1)C2
InChIInChI=1S/C12H16N4S/c1-2-12-14-3-4-16(12)7-10(1)5-13-6-11-8-17-9-15-11/h3-4,8-10,13H,1-2,5-7H2/t10-/m0/s1
InChIKeyIMGWUEHYVBRAES-JTQLQIEISA-N
MW248.35 g/mol
LogP1.69
Rot. Bonds4

About 1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine

1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine (PubChem CID 129473583) has the molecular formula C12H16N4S and a molecular weight of 248.35 g/mol. Its IUPAC name is 1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine.

Molecular Properties

Compound Name1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine
PubChem CID129473583
Molecular FormulaC12H16N4S
Molecular Weight248.35 g/mol
Exact Mass248.11
IUPAC Name1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine
SMILESc1cn2c(n1)CC[C@@H](CNCc1cscn1)C2
InChIInChI=1S/C12H16N4S/c1-2-12-14-3-4-16(12)7-10(1)5-13-6-11-8-17-9-15-11/h3-4,8-10,13H,1-2,5-7H2/t10-/m0/s1
InChIKeyIMGWUEHYVBRAES-JTQLQIEISA-N
XLogP1.69
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine with MolForge

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Related Compounds

1-(3-methyl-2-buten-1-yl)-4-[1-(1,3-thiazol-4-ylmethyl)-1H-imidazol-2-yl]piperidine
CID 70734501
1-(1-pyrrolidinylcarbonyl)-4-[1-(1,3-thiazol-4-ylmethyl)-1H-imidazol-2-yl]piperidine
CID 70750908
N,N-diethyl-5-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]-1,3-thiazol-2-amine
CID 71929157
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine
CID 71929172
N-[(2-tert-butyl-1,3-thiazol-5-yl)methyl]-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine
CID 71929200
3-(1-isopropyl-1H-imidazol-2-yl)-1-(1,3-thiazol-4-ylmethyl)piperidine
CID 72847349
N-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,3-thiazol-2-yl]acetamide
CID 86774778
N-methyl-4-({methyl[2-(2-methyl-1H-imidazol-1-yl)ethyl]amino}methyl)-1,3-thiazol-2-amine
CID 91829447
(2S)-4-(2-methylimidazol-1-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]butan-2-amine
CID 95206783
2-(2-methylpropyl)-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-4-carboxamide
CID 95765692
1-[(8R)-2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]-N-[(4-methyl-1,3-thiazol-5-yl)methyl]methanamine
CID 97002923
5-[[[(8R)-2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine
CID 97074509

Frequently Asked Questions

What is the IUPAC name of 1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine?
The IUPAC name of 1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine (CID 129473583) is 1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine.
What is the SMILES notation for 1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine?
The canonical SMILES for 1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine is c1cn2c(n1)CC[C@@H](CNCc1cscn1)C2.
What is the InChIKey of 1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine?
The InChIKey is IMGWUEHYVBRAES-JTQLQIEISA-N. The full InChI is InChI=1S/C12H16N4S/c1-2-12-14-3-4-16(12)7-10(1)5-13-6-11-8-17-9-15-11/h3-4,8-10,13H,1-2,5-7H2/t10-/m0/s1.
What are the key properties of 1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine?
1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine has a molecular weight of 248.35 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-N-(1,3-thiazol-4-ylmethyl)methanamine is sourced from PubChem (CID 129473583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).