N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide

C19H12F3N3O2 — CID 55834647

IUPACN-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1NC(=O)c1ccc(F)cc1F)c1ccccn1
InChIInChI=1S/C19H12F3N3O2/c20-11-4-6-13(14(22)9-11)18(26)25-17-10-12(21)5-7-15(17)24-19(27)16-3-1-2-8-23-16/h1-10H,(H,24,27)(H,25,26)
InChIKeyBOFSTOZWKXOPOL-UHFFFAOYSA-N
MW371.32 g/mol
LogP4.00
Rot. Bonds4

About N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide

N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide (PubChem CID 55834647) has the molecular formula C19H12F3N3O2 and a molecular weight of 371.32 g/mol. Its IUPAC name is N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide
PubChem CID55834647
Molecular FormulaC19H12F3N3O2
Molecular Weight371.32 g/mol
Exact Mass371.09
IUPAC NameN-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1NC(=O)c1ccc(F)cc1F)c1ccccn1
InChIInChI=1S/C19H12F3N3O2/c20-11-4-6-13(14(22)9-11)18(26)25-17-10-12(21)5-7-15(17)24-19(27)16-3-1-2-8-23-16/h1-10H,(H,24,27)(H,25,26)
InChIKeyBOFSTOZWKXOPOL-UHFFFAOYSA-N
XLogP4.00
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.32
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[(5-chloro-2-methoxybenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide
CID 55834271
N-[2-[3-(4-chlorophenyl)prop-2-enoylamino]-4-fluorophenyl]pyridine-2-carboxamide
CID 76869971
N-[2-(7-aminoheptanoylamino)-4-fluorophenyl]pyridine-2-carboxamide;dihydrochloride
CID 119844812
N-[4-fluoro-2-[[2-(4-fluorophenyl)sulfanylacetyl]amino]phenyl]pyridine-2-carboxamide
CID 55834013
1-(2,4-difluorophenyl)-3-(pyridine-2-carbonylamino)thiourea
CID 17373384
N-(5-fluoro-2-nitrophenyl)pyridine-2-carboxamide
CID 110461612
N-[2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide;ruthenium(2+);dichloride
CID 46845295
N-[4-methyl-2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide
CID 4867706
N-(4-chloro-2-fluorophenyl)-2,4-difluorobenzamide
CID 2572466
N-[4-fluoro-2-[3-(furan-2-yl)prop-2-enoylamino]phenyl]pyridine-2-carboxamide
CID 75896601
1-N,2-N-bis(2,4-difluorophenyl)benzene-1,2-dicarboxamide
CID 4062467
N-[4-fluoro-2-(piperidine-3-carbonylamino)phenyl]pyridine-2-carboxamide
CID 119844811

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide?
The IUPAC name of N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide (CID 55834647) is N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide is O=C(Nc1ccc(F)cc1NC(=O)c1ccc(F)cc1F)c1ccccn1.
What is the InChIKey of N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide?
The InChIKey is BOFSTOZWKXOPOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F3N3O2/c20-11-4-6-13(14(22)9-11)18(26)25-17-10-12(21)5-7-15(17)24-19(27)16-3-1-2-8-23-16/h1-10H,(H,24,27)(H,25,26).
What are the key properties of N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide?
N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide has a molecular weight of 371.32 g/mol, XLogP of 4.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide is sourced from PubChem (CID 55834647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).