2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine

C12H19N3S — CID 117153817

IUPAC2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
SMILESNC1CCc2nc(C3CCSCC3)cn2C1
InChIInChI=1S/C12H19N3S/c13-10-1-2-12-14-11(8-15(12)7-10)9-3-5-16-6-4-9/h8-10H,1-7,13H2
InChIKeyQUTGBZRQNOBXAZ-UHFFFAOYSA-N
MW237.37 g/mol
LogP1.77
Rot. Bonds1

About 2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine

2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine (PubChem CID 117153817) has the molecular formula C12H19N3S and a molecular weight of 237.37 g/mol. Its IUPAC name is 2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine.

Molecular Properties

Compound Name2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
PubChem CID117153817
Molecular FormulaC12H19N3S
Molecular Weight237.37 g/mol
Exact Mass237.13
IUPAC Name2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
SMILESNC1CCc2nc(C3CCSCC3)cn2C1
InChIInChI=1S/C12H19N3S/c13-10-1-2-12-14-11(8-15(12)7-10)9-3-5-16-6-4-9/h8-10H,1-7,13H2
InChIKeyQUTGBZRQNOBXAZ-UHFFFAOYSA-N
XLogP1.77
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.37
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methylpyrrolidin-3-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
CID 117153773
2-(thian-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
CID 117153923
2-cyclopentyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ol
CID 117154591
2-(2-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetic acid
CID 83865713
2-(2-aminophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
CID 117128402
2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
CID 117154617
2-[(6-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol
CID 117154450
2-[2-(4-methylpiperazin-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
CID 117154599
2-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxylic acid
CID 117153259
2-piperidin-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ol
CID 117154097
2-(thiolan-3-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine
CID 117157625
2-[(1,1-dioxothiolan-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
CID 117153862

Frequently Asked Questions

What is the IUPAC name of 2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
The IUPAC name of 2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine (CID 117153817) is 2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine.
What is the SMILES notation for 2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
The canonical SMILES for 2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine is NC1CCc2nc(C3CCSCC3)cn2C1.
What is the InChIKey of 2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
The InChIKey is QUTGBZRQNOBXAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3S/c13-10-1-2-12-14-11(8-15(12)7-10)9-3-5-16-6-4-9/h8-10H,1-7,13H2.
What are the key properties of 2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine has a molecular weight of 237.37 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine is sourced from PubChem (CID 117153817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).