2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine

C12H15N3S — CID 117133650

IUPAC2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine
SMILESNc1ccn2cc(C3CCSCC3)nc2c1
InChIInChI=1S/C12H15N3S/c13-10-1-4-15-8-11(14-12(15)7-10)9-2-5-16-6-3-9/h1,4,7-9H,2-3,5-6,13H2
InChIKeySNJBUUKGMKEZCX-UHFFFAOYSA-N
MW233.34 g/mol
LogP2.53
Rot. Bonds1

About 2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine

2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine (PubChem CID 117133650) has the molecular formula C12H15N3S and a molecular weight of 233.34 g/mol. Its IUPAC name is 2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine.

Molecular Properties

Compound Name2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine
PubChem CID117133650
Molecular FormulaC12H15N3S
Molecular Weight233.34 g/mol
Exact Mass233.10
IUPAC Name2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine
SMILESNc1ccn2cc(C3CCSCC3)nc2c1
InChIInChI=1S/C12H15N3S/c13-10-1-4-15-8-11(14-12(15)7-10)9-2-5-16-6-3-9/h1,4,7-9H,2-3,5-6,13H2
InChIKeySNJBUUKGMKEZCX-UHFFFAOYSA-N
XLogP2.53
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-piperidin-4-ylimidazo[1,2-a]pyridin-7-amine
CID 117133660
7-piperazin-1-yl-2-(thian-4-yl)imidazo[1,2-a]pyridine
CID 117236308
5-(thian-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 66584856
2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridin-7-amine
CID 117134191
8-methyl-2-(thian-4-yl)imidazo[1,2-a]pyridine
CID 117135947
6-methoxy-2-(thian-4-yl)imidazo[1,2-a]pyridine
CID 117128899
(2-piperidin-4-ylimidazo[1,2-a]pyridin-7-yl)methanamine
CID 117133609
1-chloro-3-(thian-4-yl)imidazo[1,5-a]pyridin-7-amine
CID 117251665
7-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine
CID 117133635
2-cyclopentyl-7-methoxyimidazo[1,2-a]pyridine
CID 117135531
2-[(1-methylpiperidin-4-yl)methyl]imidazo[1,2-a]pyridin-7-amine
CID 117133919
2-(thian-4-yl)pyrazolo[1,5-a]pyrimidin-6-amine
CID 117103504

Frequently Asked Questions

What is the IUPAC name of 2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine?
The IUPAC name of 2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine (CID 117133650) is 2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine.
What is the SMILES notation for 2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine?
The canonical SMILES for 2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine is Nc1ccn2cc(C3CCSCC3)nc2c1.
What is the InChIKey of 2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine?
The InChIKey is SNJBUUKGMKEZCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3S/c13-10-1-4-15-8-11(14-12(15)7-10)9-2-5-16-6-3-9/h1,4,7-9H,2-3,5-6,13H2.
What are the key properties of 2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine?
2-(thian-4-yl)imidazo[1,2-a]pyridin-7-amine has a molecular weight of 233.34 g/mol, XLogP of 2.53, 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)imidazo[1,2-a]pyridin-7-amine is sourced from PubChem (CID 117133650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).