N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide

C17H12F3N3O2 — CID 113034810

IUPACN-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(Nc2ccccc2C(F)(F)F)cn1)c1ccco1
InChIInChI=1S/C17H12F3N3O2/c18-17(19,20)12-4-1-2-5-13(12)22-11-7-8-15(21-10-11)23-16(24)14-6-3-9-25-14/h1-10,22H,(H,21,23,24)
InChIKeyPFGUXPRRMMGHKT-UHFFFAOYSA-N
MW347.30 g/mol
LogP4.69
Rot. Bonds4

About N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide

N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide (PubChem CID 113034810) has the molecular formula C17H12F3N3O2 and a molecular weight of 347.30 g/mol. Its IUPAC name is N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide
PubChem CID113034810
Molecular FormulaC17H12F3N3O2
Molecular Weight347.30 g/mol
Exact Mass347.09
IUPAC NameN-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(Nc2ccccc2C(F)(F)F)cn1)c1ccco1
InChIInChI=1S/C17H12F3N3O2/c18-17(19,20)12-4-1-2-5-13(12)22-11-7-8-15(21-10-11)23-16(24)14-6-3-9-25-14/h1-10,22H,(H,21,23,24)
InChIKeyPFGUXPRRMMGHKT-UHFFFAOYSA-N
XLogP4.69
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.30
LogP ≤ 54.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-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-[5-(2-ethylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113032400
N-[5-[2-chloro-5-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide
CID 113035477
N-[2-(trifluoromethyl)phenyl]furan-2-carboxamide
CID 727485
N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide
CID 113023557
N-[5-(2-morpholin-4-ylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113035740
N-[5-(4-phenoxyanilino)-2-pyridinyl]furan-2-carboxamide
CID 113035819
N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]cyclohexanecarboxamide
CID 113034806
ethyl N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]carbamate
CID 113034834
N-[5-(3-phenylpropylamino)-2-pyridinyl]furan-2-carboxamide
CID 113029807
N-[5-(4-propan-2-ylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113032758
N-[5-(3,4-dimethylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113032100
N-[5-(3-methylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113031417

Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide?
The IUPAC name of N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide (CID 113034810) is N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide.
What is the SMILES notation for N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide?
The canonical SMILES for N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide is O=C(Nc1ccc(Nc2ccccc2C(F)(F)F)cn1)c1ccco1.
What is the InChIKey of N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide?
The InChIKey is PFGUXPRRMMGHKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12F3N3O2/c18-17(19,20)12-4-1-2-5-13(12)22-11-7-8-15(21-10-11)23-16(24)14-6-3-9-25-14/h1-10,22H,(H,21,23,24).
What are the key properties of N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide?
N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide has a molecular weight of 347.30 g/mol, XLogP of 4.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide is sourced from PubChem (CID 113034810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).