N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide

C24H22FN5O2 — CID 90094843

IUPACN-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide
SMILESCc1cc(-c2ncc(NC(=O)N3CCOCC3)cc2-c2ccc3nccn3c2)ccc1F
InChIInChI=1S/C24H22FN5O2/c1-16-12-17(2-4-21(16)25)23-20(18-3-5-22-26-6-7-30(22)15-18)13-19(14-27-23)28-24(31)29-8-10-32-11-9-29/h2-7,12-15H,8-11H2,1H3,(H,28,31)
InChIKeyHWJGMOMQGRDETA-UHFFFAOYSA-N
MW431.47 g/mol
LogP4.37
Rot. Bonds3

About N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide

N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide (PubChem CID 90094843) has the molecular formula C24H22FN5O2 and a molecular weight of 431.47 g/mol. Its IUPAC name is N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide
PubChem CID90094843
Molecular FormulaC24H22FN5O2
Molecular Weight431.47 g/mol
Exact Mass431.18
IUPAC NameN-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide
SMILESCc1cc(-c2ncc(NC(=O)N3CCOCC3)cc2-c2ccc3nccn3c2)ccc1F
InChIInChI=1S/C24H22FN5O2/c1-16-12-17(2-4-21(16)25)23-20(18-3-5-22-26-6-7-30(22)15-18)13-19(14-27-23)28-24(31)29-8-10-32-11-9-29/h2-7,12-15H,8-11H2,1H3,(H,28,31)
InChIKeyHWJGMOMQGRDETA-UHFFFAOYSA-N
XLogP4.37
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.47
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide?
The IUPAC name of N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide (CID 90094843) is N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide.
What is the SMILES notation for N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide?
The canonical SMILES for N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide is Cc1cc(-c2ncc(NC(=O)N3CCOCC3)cc2-c2ccc3nccn3c2)ccc1F.
What is the InChIKey of N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide?
The InChIKey is HWJGMOMQGRDETA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22FN5O2/c1-16-12-17(2-4-21(16)25)23-20(18-3-5-22-26-6-7-30(22)15-18)13-19(14-27-23)28-24(31)29-8-10-32-11-9-29/h2-7,12-15H,8-11H2,1H3,(H,28,31).
What are the key properties of N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide?
N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide has a molecular weight of 431.47 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-fluoro-3-methylphenyl)-5-imidazo[1,2-a]pyridin-6-yl-3-pyridinyl]morpholine-4-carboxamide is sourced from PubChem (CID 90094843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).