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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Related Compounds

Zolimidine
CID 14652
2-Phenylimidazo(1,2-a)pyridin-3-amine
CID 199307
E6Clv6G2RR
CID 16750138
Imidazopyridine 10e
CID 5329344
Imidazopyridine 10f
CID 5329345
6-(thiophen-3-yl)-5H-pyrrolo[2,3-b]pyrazine
CID 6538803
1-[(4-methylphenyl)methyl]-4-(thiophen-3-yl)-1H-imidazole
CID 6539905
Ikk-IN-3
CID 10215156
N,4,12-trimethyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20823920
12-Methyl-4-phenyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20823959
N,12-dimethyl-4-phenyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20823960
12-methyl-4-phenyl-N-[2-(piperidin-1-yl)ethyl]-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20823975

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).