5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide

C23H15N3O3 — CID 2886207

IUPAC5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide
SMILESO=C(Nc1ccc2oc(-c3cccnc3)nc2c1)c1ccc(-c2ccccc2)o1
InChIInChI=1S/C23H15N3O3/c27-22(21-11-10-19(28-21)15-5-2-1-3-6-15)25-17-8-9-20-18(13-17)26-23(29-20)16-7-4-12-24-14-16/h1-14H,(H,25,27)
InChIKeyUDNPXDAMRUEUJW-UHFFFAOYSA-N
MW381.39 g/mol
LogP5.40
Rot. Bonds4

About 5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide

5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide (PubChem CID 2886207) has the molecular formula C23H15N3O3 and a molecular weight of 381.39 g/mol. Its IUPAC name is 5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide
PubChem CID2886207
Molecular FormulaC23H15N3O3
Molecular Weight381.39 g/mol
Exact Mass381.11
IUPAC Name5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide
SMILESO=C(Nc1ccc2oc(-c3cccnc3)nc2c1)c1ccc(-c2ccccc2)o1
InChIInChI=1S/C23H15N3O3/c27-22(21-11-10-19(28-21)15-5-2-1-3-6-15)25-17-8-9-20-18(13-17)26-23(29-20)16-7-4-12-24-14-16/h1-14H,(H,25,27)
InChIKeyUDNPXDAMRUEUJW-UHFFFAOYSA-N
XLogP5.40
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.39
LogP ≤ 55.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide?
The IUPAC name of 5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide (CID 2886207) is 5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide.
What is the SMILES notation for 5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide?
The canonical SMILES for 5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide is O=C(Nc1ccc2oc(-c3cccnc3)nc2c1)c1ccc(-c2ccccc2)o1.
What is the InChIKey of 5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide?
The InChIKey is UDNPXDAMRUEUJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15N3O3/c27-22(21-11-10-19(28-21)15-5-2-1-3-6-15)25-17-8-9-20-18(13-17)26-23(29-20)16-7-4-12-24-14-16/h1-14H,(H,25,27).
What are the key properties of 5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide?
5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide has a molecular weight of 381.39 g/mol, XLogP of 5.40, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide is sourced from PubChem (CID 2886207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).