N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide

C17H11N3O3 — CID 39311457

IUPACN-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(-c2nc3cnccc3o2)cc1)c1ccco1
InChIInChI=1S/C17H11N3O3/c21-16(15-2-1-9-22-15)19-12-5-3-11(4-6-12)17-20-13-10-18-8-7-14(13)23-17/h1-10H,(H,19,21)
InChIKeyOTAJUCXOZOTCPB-UHFFFAOYSA-N
MW305.29 g/mol
LogP3.74
Rot. Bonds3

About N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide

N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide (PubChem CID 39311457) has the molecular formula C17H11N3O3 and a molecular weight of 305.29 g/mol. Its IUPAC name is N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide
PubChem CID39311457
Molecular FormulaC17H11N3O3
Molecular Weight305.29 g/mol
Exact Mass305.08
IUPAC NameN-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(-c2nc3cnccc3o2)cc1)c1ccco1
InChIInChI=1S/C17H11N3O3/c21-16(15-2-1-9-22-15)19-12-5-3-11(4-6-12)17-20-13-10-18-8-7-14(13)23-17/h1-10H,(H,19,21)
InChIKeyOTAJUCXOZOTCPB-UHFFFAOYSA-N
XLogP3.74
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.29
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide (CID 39311457) is N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide is O=C(Nc1ccc(-c2nc3cnccc3o2)cc1)c1ccco1.
What is the InChIKey of N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide?
The InChIKey is OTAJUCXOZOTCPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N3O3/c21-16(15-2-1-9-22-15)19-12-5-3-11(4-6-12)17-20-13-10-18-8-7-14(13)23-17/h1-10H,(H,19,21).
What are the key properties of N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide?
N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide has a molecular weight of 305.29 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 39311457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).