3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide

C23H16N4O2 — CID 97410717

IUPAC3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide
SMILESO=C(Nc1cccnc1)c1cc2ccc(-c3ccccc3)cn2c1-c1cocn1
InChIInChI=1S/C23H16N4O2/c28-23(26-18-7-4-10-24-12-18)20-11-19-9-8-17(16-5-2-1-3-6-16)13-27(19)22(20)21-14-29-15-25-21/h1-15H,(H,26,28)
InChIKeyXRRMMRKVDAYEFS-UHFFFAOYSA-N
MW380.41 g/mol
LogP4.91
Rot. Bonds4

About 3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide

3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide (PubChem CID 97410717) has the molecular formula C23H16N4O2 and a molecular weight of 380.41 g/mol. Its IUPAC name is 3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide.

Molecular Properties

Compound Name3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide
PubChem CID97410717
Molecular FormulaC23H16N4O2
Molecular Weight380.41 g/mol
Exact Mass380.13
IUPAC Name3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide
SMILESO=C(Nc1cccnc1)c1cc2ccc(-c3ccccc3)cn2c1-c1cocn1
InChIInChI=1S/C23H16N4O2/c28-23(26-18-7-4-10-24-12-18)20-11-19-9-8-17(16-5-2-1-3-6-16)13-27(19)22(20)21-14-29-15-25-21/h1-15H,(H,26,28)
InChIKeyXRRMMRKVDAYEFS-UHFFFAOYSA-N
XLogP4.91
TPSA72.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.41
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide?
The IUPAC name of 3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide (CID 97410717) is 3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide.
What is the SMILES notation for 3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide?
The canonical SMILES for 3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide is O=C(Nc1cccnc1)c1cc2ccc(-c3ccccc3)cn2c1-c1cocn1.
What is the InChIKey of 3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide?
The InChIKey is XRRMMRKVDAYEFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N4O2/c28-23(26-18-7-4-10-24-12-18)20-11-19-9-8-17(16-5-2-1-3-6-16)13-27(19)22(20)21-14-29-15-25-21/h1-15H,(H,26,28).
What are the key properties of 3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide?
3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide has a molecular weight of 380.41 g/mol, XLogP of 4.91, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3-oxazol-4-yl)-6-phenyl-N-pyridin-3-ylindolizine-2-carboxamide is sourced from PubChem (CID 97410717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).