3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide

C17H13F2N3O2 — CID 113026285

IUPAC3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide
SMILESO=C(Nc1ccc(NCc2ccco2)cn1)c1ccc(F)c(F)c1
InChIInChI=1S/C17H13F2N3O2/c18-14-5-3-11(8-15(14)19)17(23)22-16-6-4-12(9-21-16)20-10-13-2-1-7-24-13/h1-9,20H,10H2,(H,21,22,23)
InChIKeyXNLNLPWBDCGYTD-UHFFFAOYSA-N
MW329.31 g/mol
LogP3.82
Rot. Bonds5

About 3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide

3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide (PubChem CID 113026285) has the molecular formula C17H13F2N3O2 and a molecular weight of 329.31 g/mol. Its IUPAC name is 3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide.

Molecular Properties

Compound Name3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide
PubChem CID113026285
Molecular FormulaC17H13F2N3O2
Molecular Weight329.31 g/mol
Exact Mass329.10
IUPAC Name3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide
SMILESO=C(Nc1ccc(NCc2ccco2)cn1)c1ccc(F)c(F)c1
InChIInChI=1S/C17H13F2N3O2/c18-14-5-3-11(8-15(14)19)17(23)22-16-6-4-12(9-21-16)20-10-13-2-1-7-24-13/h1-9,20H,10H2,(H,21,22,23)
InChIKeyXNLNLPWBDCGYTD-UHFFFAOYSA-N
XLogP3.82
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.31
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,4-difluoro-N-[5-(pyridin-2-ylmethylamino)-2-pyridinyl]benzamide
CID 113027675
N-(3,4-difluorophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231628
2,3,4-trifluoro-N-[6-(furan-2-ylmethylamino)-3-pyridinyl]benzamide
CID 113011352
3,4-difluoro-N-[5-[(2-methoxyphenyl)methylamino]-2-pyridinyl]benzamide
CID 113027357
2-fluoro-N-[6-(furan-2-ylmethylamino)-3-pyridinyl]benzamide
CID 113011312
N-[5-(furan-2-ylmethylamino)-2-pyridinyl]thiophene-2-carboxamide
CID 113026241
N-[5-(furan-2-ylmethylamino)-2-pyridinyl]pentanamide
CID 113026234
3-amino-N-[6-(furan-2-ylmethylamino)-3-pyridinyl]propanamide
CID 39179353
3,4-difluoro-N-[5-(1-phenylethylamino)-2-pyridinyl]benzamide
CID 113026825
N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 113026265
N-(2,4-difluorophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231606
4-chloro-N-[5-[(4-chlorophenyl)methylamino]-2-pyridinyl]benzamide
CID 113027275

Frequently Asked Questions

What is the IUPAC name of 3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide?
The IUPAC name of 3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide (CID 113026285) is 3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide.
What is the SMILES notation for 3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide?
The canonical SMILES for 3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide is O=C(Nc1ccc(NCc2ccco2)cn1)c1ccc(F)c(F)c1.
What is the InChIKey of 3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide?
The InChIKey is XNLNLPWBDCGYTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F2N3O2/c18-14-5-3-11(8-15(14)19)17(23)22-16-6-4-12(9-21-16)20-10-13-2-1-7-24-13/h1-9,20H,10H2,(H,21,22,23).
What are the key properties of 3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide?
3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide has a molecular weight of 329.31 g/mol, XLogP of 3.82, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide is sourced from PubChem (CID 113026285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).