N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide

C22H15N3OS — CID 4559296

IUPACN-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide
SMILESO=C(Nc1c(-c2cccs2)nc2ccccn12)c1ccc2ccccc2c1
InChIInChI=1S/C22H15N3OS/c26-22(17-11-10-15-6-1-2-7-16(15)14-17)24-21-20(18-8-5-13-27-18)23-19-9-3-4-12-25(19)21/h1-14H,(H,24,26)
InChIKeyPKRQQAGYXAEKLO-UHFFFAOYSA-N
MW369.45 g/mol
LogP5.47
Rot. Bonds3

About N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide

N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide (PubChem CID 4559296) has the molecular formula C22H15N3OS and a molecular weight of 369.45 g/mol. Its IUPAC name is N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide
PubChem CID4559296
Molecular FormulaC22H15N3OS
Molecular Weight369.45 g/mol
Exact Mass369.09
IUPAC NameN-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide
SMILESO=C(Nc1c(-c2cccs2)nc2ccccn12)c1ccc2ccccc2c1
InChIInChI=1S/C22H15N3OS/c26-22(17-11-10-15-6-1-2-7-16(15)14-17)24-21-20(18-8-5-13-27-18)23-19-9-3-4-12-25(19)21/h1-14H,(H,24,26)
InChIKeyPKRQQAGYXAEKLO-UHFFFAOYSA-N
XLogP5.47
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.45
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide?
The IUPAC name of N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide (CID 4559296) is N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide.
What is the SMILES notation for N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide?
The canonical SMILES for N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide is O=C(Nc1c(-c2cccs2)nc2ccccn12)c1ccc2ccccc2c1.
What is the InChIKey of N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide?
The InChIKey is PKRQQAGYXAEKLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N3OS/c26-22(17-11-10-15-6-1-2-7-16(15)14-17)24-21-20(18-8-5-13-27-18)23-19-9-3-4-12-25(19)21/h1-14H,(H,24,26).
What are the key properties of N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide?
N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide has a molecular weight of 369.45 g/mol, XLogP of 5.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)naphthalene-2-carboxamide is sourced from PubChem (CID 4559296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).