5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide

C18H14F3N3O2 — CID 109231573

IUPAC5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1ccccc1C(F)(F)F)c1cncc(NCc2ccco2)c1
InChIInChI=1S/C18H14F3N3O2/c19-18(20,21)15-5-1-2-6-16(15)24-17(25)12-8-13(10-22-9-12)23-11-14-4-3-7-26-14/h1-10,23H,11H2,(H,24,25)
InChIKeyJXPKDPTUJDVRBE-UHFFFAOYSA-N
MW361.32 g/mol
LogP4.56
Rot. Bonds5

About 5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide

5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide (PubChem CID 109231573) has the molecular formula C18H14F3N3O2 and a molecular weight of 361.32 g/mol. Its IUPAC name is 5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
PubChem CID109231573
Molecular FormulaC18H14F3N3O2
Molecular Weight361.32 g/mol
Exact Mass361.10
IUPAC Name5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1ccccc1C(F)(F)F)c1cncc(NCc2ccco2)c1
InChIInChI=1S/C18H14F3N3O2/c19-18(20,21)15-5-1-2-6-16(15)24-17(25)12-8-13(10-22-9-12)23-11-14-4-3-7-26-14/h1-10,23H,11H2,(H,24,25)
InChIKeyJXPKDPTUJDVRBE-UHFFFAOYSA-N
XLogP4.56
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.32
LogP ≤ 54.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide 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

N-(2-ethylphenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231536
N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231622
5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109231540
5-(propylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109223099
N-(2,4-difluorophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231606
5-(furan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109231568
5-(prop-2-enylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109224282
N-(3,4-difluorophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231628
N-(3,5-dichlorophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231615
5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyrazine-2-carboxamide
CID 109279581
5-(furan-2-ylmethylamino)-N-propylpyridine-3-carboxamide
CID 109222782
5-(furan-2-ylmethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 109231475

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide (CID 109231573) is 5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide is O=C(Nc1ccccc1C(F)(F)F)c1cncc(NCc2ccco2)c1.
What is the InChIKey of 5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
The InChIKey is JXPKDPTUJDVRBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F3N3O2/c19-18(20,21)15-5-1-2-6-16(15)24-17(25)12-8-13(10-22-9-12)23-11-14-4-3-7-26-14/h1-10,23H,11H2,(H,24,25).
What are the key properties of 5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide has a molecular weight of 361.32 g/mol, XLogP of 4.56, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 109231573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).