N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide

C17H13Cl2N3O2 — CID 109169407

IUPACN-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1ccnc(NCc2ccco2)c1
InChIInChI=1S/C17H13Cl2N3O2/c18-12-7-13(19)9-14(8-12)22-17(23)11-3-4-20-16(6-11)21-10-15-2-1-5-24-15/h1-9H,10H2,(H,20,21)(H,22,23)
InChIKeyAXAXEYWAVHWYQE-UHFFFAOYSA-N
MW362.22 g/mol
LogP4.85
Rot. Bonds5

About N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide

N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide (PubChem CID 109169407) has the molecular formula C17H13Cl2N3O2 and a molecular weight of 362.22 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide
PubChem CID109169407
Molecular FormulaC17H13Cl2N3O2
Molecular Weight362.22 g/mol
Exact Mass361.04
IUPAC NameN-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1ccnc(NCc2ccco2)c1
InChIInChI=1S/C17H13Cl2N3O2/c18-12-7-13(19)9-14(8-12)22-17(23)11-3-4-20-16(6-11)21-10-15-2-1-5-24-15/h1-9H,10H2,(H,20,21)(H,22,23)
InChIKeyAXAXEYWAVHWYQE-UHFFFAOYSA-N
XLogP4.85
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.22
LogP ≤ 54.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(furan-2-ylmethylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-4-carboxamide
CID 109169400
N-(3,5-dichlorophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231615
N-(2-bromo-4-methylphenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide
CID 109169394
3-chloro-N-[6-(furan-2-ylmethylamino)pyridazin-3-yl]benzamide
CID 113040674
6-(furan-2-ylmethylamino)-N-phenylpyrimidine-4-carboxamide
CID 109346189
N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide
CID 62172710
N-(4-chlorophenyl)-2-[(2-chlorophenyl)methylamino]pyridine-4-carboxamide
CID 109170825
N-(3-chloro-5-fluorophenyl)-2-hydrazinylpyridine-4-carboxamide
CID 107370610
4-N-(3,5-dimethylphenyl)-2-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109085201
2-(furan-2-ylmethylamino)-N-phenylpyrimidine-4-carboxamide
CID 109303311
2-(furan-2-ylmethylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 109169326
3,4-difluoro-N-[5-(furan-2-ylmethylamino)-2-pyridinyl]benzamide
CID 113026285

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide?
The IUPAC name of N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide (CID 109169407) is N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide is O=C(Nc1cc(Cl)cc(Cl)c1)c1ccnc(NCc2ccco2)c1.
What is the InChIKey of N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide?
The InChIKey is AXAXEYWAVHWYQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13Cl2N3O2/c18-12-7-13(19)9-14(8-12)22-17(23)11-3-4-20-16(6-11)21-10-15-2-1-5-24-15/h1-9H,10H2,(H,20,21)(H,22,23).
What are the key properties of N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide?
N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide has a molecular weight of 362.22 g/mol, XLogP of 4.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-2-(furan-2-ylmethylamino)pyridine-4-carboxamide is sourced from PubChem (CID 109169407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).