N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide

C18H13N3OS — CID 698279

IUPACN-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide
SMILESO=C(Nc1c(-c2ccccc2)nc2ccccn12)c1cccs1
InChIInChI=1S/C18H13N3OS/c22-18(14-9-6-12-23-14)20-17-16(13-7-2-1-3-8-13)19-15-10-4-5-11-21(15)17/h1-12H,(H,20,22)
InChIKeyQOJBRKRLGPSKQR-UHFFFAOYSA-N
MW319.39 g/mol
LogP4.32
Rot. Bonds3

About N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide

N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide (PubChem CID 698279) has the molecular formula C18H13N3OS and a molecular weight of 319.39 g/mol. Its IUPAC name is N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide
PubChem CID698279
Molecular FormulaC18H13N3OS
Molecular Weight319.39 g/mol
Exact Mass319.08
IUPAC NameN-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide
SMILESO=C(Nc1c(-c2ccccc2)nc2ccccn12)c1cccs1
InChIInChI=1S/C18H13N3OS/c22-18(14-9-6-12-23-14)20-17-16(13-7-2-1-3-8-13)19-15-10-4-5-11-21(15)17/h1-12H,(H,20,22)
InChIKeyQOJBRKRLGPSKQR-UHFFFAOYSA-N
XLogP4.32
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.39
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide?
The IUPAC name of N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide (CID 698279) is N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide is O=C(Nc1c(-c2ccccc2)nc2ccccn12)c1cccs1.
What is the InChIKey of N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide?
The InChIKey is QOJBRKRLGPSKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3OS/c22-18(14-9-6-12-23-14)20-17-16(13-7-2-1-3-8-13)19-15-10-4-5-11-21(15)17/h1-12H,(H,20,22).
What are the key properties of N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide?
N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide has a molecular weight of 319.39 g/mol, XLogP of 4.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylimidazo[1,2-a]pyridin-3-yl)thiophene-2-carboxamide is sourced from PubChem (CID 698279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).