N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide

C23H21N3O2 — CID 70706926

IUPACN-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(c1ccc2nc(-c3ccccc3)cn2c1)N(CCO)Cc1ccccc1
InChIInChI=1S/C23H21N3O2/c27-14-13-25(15-18-7-3-1-4-8-18)23(28)20-11-12-22-24-21(17-26(22)16-20)19-9-5-2-6-10-19/h1-12,16-17,27H,13-15H2
InChIKeyIVEKTLCDGMRDKR-UHFFFAOYSA-N
MW371.44 g/mol
LogP3.64
Rot. Bonds6

About N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide

N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 70706926) has the molecular formula C23H21N3O2 and a molecular weight of 371.44 g/mol. Its IUPAC name is N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide
PubChem CID70706926
Molecular FormulaC23H21N3O2
Molecular Weight371.44 g/mol
Exact Mass371.16
IUPAC NameN-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(c1ccc2nc(-c3ccccc3)cn2c1)N(CCO)Cc1ccccc1
InChIInChI=1S/C23H21N3O2/c27-14-13-25(15-18-7-3-1-4-8-18)23(28)20-11-12-22-24-21(17-26(22)16-20)19-9-5-2-6-10-19/h1-12,16-17,27H,13-15H2
InChIKeyIVEKTLCDGMRDKR-UHFFFAOYSA-N
XLogP3.64
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide (CID 70706926) is N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide is O=C(c1ccc2nc(-c3ccccc3)cn2c1)N(CCO)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is IVEKTLCDGMRDKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O2/c27-14-13-25(15-18-7-3-1-4-8-18)23(28)20-11-12-22-24-21(17-26(22)16-20)19-9-5-2-6-10-19/h1-12,16-17,27H,13-15H2.
What are the key properties of N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide?
N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 371.44 g/mol, XLogP of 3.64, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(2-hydroxyethyl)-2-phenylimidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 70706926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).