[1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone

C26H23N3O3 — CID 45243380

IUPAC[1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone
SMILESO=C(c1ccc(Oc2ccccc2)cc1)C1CCCN(C(=O)c2cn3ccccc3n2)C1
InChIInChI=1S/C26H23N3O3/c30-25(19-11-13-22(14-12-19)32-21-8-2-1-3-9-21)20-7-6-16-29(17-20)26(31)23-18-28-15-5-4-10-24(28)27-23/h1-5,8-15,18,20H,6-7,16-17H2
InChIKeyLTCNULFQTGUSMH-UHFFFAOYSA-N
MW425.49 g/mol
LogP4.86
Rot. Bonds5

About [1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone

[1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone (PubChem CID 45243380) has the molecular formula C26H23N3O3 and a molecular weight of 425.49 g/mol. Its IUPAC name is [1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone.

Molecular Properties

Compound Name[1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone
PubChem CID45243380
Molecular FormulaC26H23N3O3
Molecular Weight425.49 g/mol
Exact Mass425.17
IUPAC Name[1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone
SMILESO=C(c1ccc(Oc2ccccc2)cc1)C1CCCN(C(=O)c2cn3ccccc3n2)C1
InChIInChI=1S/C26H23N3O3/c30-25(19-11-13-22(14-12-19)32-21-8-2-1-3-9-21)20-7-6-16-29(17-20)26(31)23-18-28-15-5-4-10-24(28)27-23/h1-5,8-15,18,20H,6-7,16-17H2
InChIKeyLTCNULFQTGUSMH-UHFFFAOYSA-N
XLogP4.86
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.49
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone?
The IUPAC name of [1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone (CID 45243380) is [1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone.
What is the SMILES notation for [1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone?
The canonical SMILES for [1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone is O=C(c1ccc(Oc2ccccc2)cc1)C1CCCN(C(=O)c2cn3ccccc3n2)C1.
What is the InChIKey of [1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone?
The InChIKey is LTCNULFQTGUSMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N3O3/c30-25(19-11-13-22(14-12-19)32-21-8-2-1-3-9-21)20-7-6-16-29(17-20)26(31)23-18-28-15-5-4-10-24(28)27-23/h1-5,8-15,18,20H,6-7,16-17H2.
What are the key properties of [1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone?
[1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone has a molecular weight of 425.49 g/mol, XLogP of 4.86, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone is sourced from PubChem (CID 45243380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).