N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine

C18H15N3S — CID 808655

IUPACN-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine
SMILESc1ccc(CNc2c(-c3cccs3)nc3ccccn23)cc1
InChIInChI=1S/C18H15N3S/c1-2-7-14(8-3-1)13-19-18-17(15-9-6-12-22-15)20-16-10-4-5-11-21(16)18/h1-12,19H,13H2
InChIKeyNJAVVNOILNLFJD-UHFFFAOYSA-N
MW305.41 g/mol
LogP4.67
Rot. Bonds4

About N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine

N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine (PubChem CID 808655) has the molecular formula C18H15N3S and a molecular weight of 305.41 g/mol. Its IUPAC name is N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine
PubChem CID808655
Molecular FormulaC18H15N3S
Molecular Weight305.41 g/mol
Exact Mass305.10
IUPAC NameN-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine
SMILESc1ccc(CNc2c(-c3cccs3)nc3ccccn23)cc1
InChIInChI=1S/C18H15N3S/c1-2-7-14(8-3-1)13-19-18-17(15-9-6-12-22-15)20-16-10-4-5-11-21(16)18/h1-12,19H,13H2
InChIKeyNJAVVNOILNLFJD-UHFFFAOYSA-N
XLogP4.67
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.41
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine (CID 808655) is N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine is c1ccc(CNc2c(-c3cccs3)nc3ccccn23)cc1.
What is the InChIKey of N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is NJAVVNOILNLFJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3S/c1-2-7-14(8-3-1)13-19-18-17(15-9-6-12-22-15)20-16-10-4-5-11-21(16)18/h1-12,19H,13H2.
What are the key properties of N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine?
N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 305.41 g/mol, XLogP of 4.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 808655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).