2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide

C23H26FN3O2 — CID 164620410

IUPAC2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCC(C)(O)C1CCC(NC(=O)c2ccc3nc(-c4cccc(F)c4)cn3c2)CC1
InChIInChI=1S/C23H26FN3O2/c1-23(2,29)17-7-9-19(10-8-17)25-22(28)16-6-11-21-26-20(14-27(21)13-16)15-4-3-5-18(24)12-15/h3-6,11-14,17,19,29H,7-10H2,1-2H3,(H,25,28)
InChIKeyDVQJGJOMWYRHFI-UHFFFAOYSA-N
MW395.48 g/mol
LogP4.20
Rot. Bonds4

About 2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide

2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 164620410) has the molecular formula C23H26FN3O2 and a molecular weight of 395.48 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID164620410
Molecular FormulaC23H26FN3O2
Molecular Weight395.48 g/mol
Exact Mass395.20
IUPAC Name2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCC(C)(O)C1CCC(NC(=O)c2ccc3nc(-c4cccc(F)c4)cn3c2)CC1
InChIInChI=1S/C23H26FN3O2/c1-23(2,29)17-7-9-19(10-8-17)25-22(28)16-6-11-21-26-20(14-27(21)13-16)15-4-3-5-18(24)12-15/h3-6,11-14,17,19,29H,7-10H2,1-2H3,(H,25,28)
InChIKeyDVQJGJOMWYRHFI-UHFFFAOYSA-N
XLogP4.20
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.48
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide (CID 164620410) is 2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide is CC(C)(O)C1CCC(NC(=O)c2ccc3nc(-c4cccc(F)c4)cn3c2)CC1.
What is the InChIKey of 2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is DVQJGJOMWYRHFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26FN3O2/c1-23(2,29)17-7-9-19(10-8-17)25-22(28)16-6-11-21-26-20(14-27(21)13-16)15-4-3-5-18(24)12-15/h3-6,11-14,17,19,29H,7-10H2,1-2H3,(H,25,28).
What are the key properties of 2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide?
2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 395.48 g/mol, XLogP of 4.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-[4-(2-hydroxypropan-2-yl)cyclohexyl]imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 164620410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).