6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide

C33H32N6O3 — CID 158129245

IUPAC6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCC(C)c1ccc2nc(C(=O)Nc3ccccc3)cn2c1.CC(O)c1ccc2nc(C(=O)Nc3ccccc3)cn2c1
InChIInChI=1S/C17H17N3O.C16H15N3O2/c1-12(2)13-8-9-16-19-15(11-20(16)10-13)17(21)18-14-6-4-3-5-7-14;1-11(20)12-7-8-15-18-14(10-19(15)9-12)16(21)17-13-5-3-2-4-6-13/h3-12H,1-2H3,(H,18,21);2-11,20H,1H3,(H,17,21)
InChIKeyFSOKTXWIPFNIKH-UHFFFAOYSA-N
MW560.66 g/mol
LogP6.35
Rot. Bonds6

About 6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide

6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 158129245) has the molecular formula C33H32N6O3 and a molecular weight of 560.66 g/mol. Its IUPAC name is 6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID158129245
Molecular FormulaC33H32N6O3
Molecular Weight560.66 g/mol
Exact Mass560.25
IUPAC Name6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCC(C)c1ccc2nc(C(=O)Nc3ccccc3)cn2c1.CC(O)c1ccc2nc(C(=O)Nc3ccccc3)cn2c1
InChIInChI=1S/C17H17N3O.C16H15N3O2/c1-12(2)13-8-9-16-19-15(11-20(16)10-13)17(21)18-14-6-4-3-5-7-14;1-11(20)12-7-8-15-18-14(10-19(15)9-12)16(21)17-13-5-3-2-4-6-13/h3-12H,1-2H3,(H,18,21);2-11,20H,1H3,(H,17,21)
InChIKeyFSOKTXWIPFNIKH-UHFFFAOYSA-N
XLogP6.35
TPSA113.03 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500560.66
LogP ≤ 56.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide (CID 158129245) is 6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide is CC(C)c1ccc2nc(C(=O)Nc3ccccc3)cn2c1.CC(O)c1ccc2nc(C(=O)Nc3ccccc3)cn2c1.
What is the InChIKey of 6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is FSOKTXWIPFNIKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O.C16H15N3O2/c1-12(2)13-8-9-16-19-15(11-20(16)10-13)17(21)18-14-6-4-3-5-7-14;1-11(20)12-7-8-15-18-14(10-19(15)9-12)16(21)17-13-5-3-2-4-6-13/h3-12H,1-2H3,(H,18,21);2-11,20H,1H3,(H,17,21).
What are the key properties of 6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide?
6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 560.66 g/mol, XLogP of 6.35, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-hydroxyethyl)-N-phenylimidazo[1,2-a]pyridine-2-carboxamide;N-phenyl-6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 158129245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).