N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide

C17H16N2O3 — CID 129283317

IUPACN-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide
SMILESCC(C)c1ccc(-c2cc3cc(C(=O)NO)cnc3o2)cc1
InChIInChI=1S/C17H16N2O3/c1-10(2)11-3-5-12(6-4-11)15-8-13-7-14(16(20)19-21)9-18-17(13)22-15/h3-10,21H,1-2H3,(H,19,20)
InChIKeyBFFLLQYEXGNTDM-UHFFFAOYSA-N
MW296.33 g/mol
LogP3.74
Rot. Bonds3

About N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide

N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide (PubChem CID 129283317) has the molecular formula C17H16N2O3 and a molecular weight of 296.33 g/mol. Its IUPAC name is N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide
PubChem CID129283317
Molecular FormulaC17H16N2O3
Molecular Weight296.33 g/mol
Exact Mass296.12
IUPAC NameN-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide
SMILESCC(C)c1ccc(-c2cc3cc(C(=O)NO)cnc3o2)cc1
InChIInChI=1S/C17H16N2O3/c1-10(2)11-3-5-12(6-4-11)15-8-13-7-14(16(20)19-21)9-18-17(13)22-15/h3-10,21H,1-2H3,(H,19,20)
InChIKeyBFFLLQYEXGNTDM-UHFFFAOYSA-N
XLogP3.74
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide?
The IUPAC name of N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide (CID 129283317) is N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide.
What is the SMILES notation for N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide?
The canonical SMILES for N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide is CC(C)c1ccc(-c2cc3cc(C(=O)NO)cnc3o2)cc1.
What is the InChIKey of N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide?
The InChIKey is BFFLLQYEXGNTDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O3/c1-10(2)11-3-5-12(6-4-11)15-8-13-7-14(16(20)19-21)9-18-17(13)22-15/h3-10,21H,1-2H3,(H,19,20).
What are the key properties of N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide?
N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide has a molecular weight of 296.33 g/mol, XLogP of 3.74, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-(4-propan-2-ylphenyl)furo[2,3-b]pyridine-5-carboxamide is sourced from PubChem (CID 129283317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).