2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide

C14H10Cl2F3N3O — CID 59618340

IUPAC2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide
SMILESO=C(Nc1ccnc(NCC(F)(F)F)c1)c1c(Cl)cccc1Cl
InChIInChI=1S/C14H10Cl2F3N3O/c15-9-2-1-3-10(16)12(9)13(23)22-8-4-5-20-11(6-8)21-7-14(17,18)19/h1-6H,7H2,(H2,20,21,22,23)
InChIKeyXAOUKOIPDZPBSQ-UHFFFAOYSA-N
MW364.15 g/mol
LogP4.61
Rot. Bonds4

About 2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide

2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide (PubChem CID 59618340) has the molecular formula C14H10Cl2F3N3O and a molecular weight of 364.15 g/mol. Its IUPAC name is 2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide
PubChem CID59618340
Molecular FormulaC14H10Cl2F3N3O
Molecular Weight364.15 g/mol
Exact Mass363.02
IUPAC Name2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide
SMILESO=C(Nc1ccnc(NCC(F)(F)F)c1)c1c(Cl)cccc1Cl
InChIInChI=1S/C14H10Cl2F3N3O/c15-9-2-1-3-10(16)12(9)13(23)22-8-4-5-20-11(6-8)21-7-14(17,18)19/h1-6H,7H2,(H2,20,21,22,23)
InChIKeyXAOUKOIPDZPBSQ-UHFFFAOYSA-N
XLogP4.61
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.15
LogP ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dichloro-N-[2-[(2-cyanoacetyl)amino]-4-pyridinyl]benzamide
CID 59618360
2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide
CID 59618171
2,6-dichloro-N-[2-[[(1R,2S)-2-fluorocyclopropanecarbonyl]amino]-4-pyridinyl]benzamide
CID 59618118
2,6-dichloro-N-[2-[[2-(methylamino)-6-(trifluoromethyl)pyrimidin-4-yl]amino]-4-pyridinyl]benzamide
CID 68672351
N-[2-(benzylcarbamoylamino)-4-pyridinyl]-2,6-dichlorobenzamide
CID 59618071
2,6-dichloro-N-[2-[[5-(hydroxymethyl)-2-pyridinyl]amino]-4-pyridinyl]benzamide
CID 59618575
2,6-dichloro-N-[2-[[(1R,2S)-2-methylcyclopropanecarbonyl]amino]-4-pyridinyl]benzamide
CID 59618440
2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide
CID 59618587
2,6-dichloro-N-[2-[[5-(dimethylamino)-2-pyridinyl]amino]-4-pyridinyl]benzamide
CID 59618178
2,6-dichloro-N-[2-[(5-cyano-6-methyl-2-pyridinyl)amino]-4-pyridinyl]benzamide
CID 59617943
methyl 6-[[4-[(2,6-dichlorobenzoyl)amino]-2-pyridinyl]amino]pyridine-2-carboxylate
CID 59617969
2,6-dichloro-N-[2-[[2-[[(2S)-1-hydroxypropan-2-yl]amino]-6-methylpyrimidin-4-yl]amino]-4-pyridinyl]benzamide
CID 68672618

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide?
The IUPAC name of 2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide (CID 59618340) is 2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide is O=C(Nc1ccnc(NCC(F)(F)F)c1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide?
The InChIKey is XAOUKOIPDZPBSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2F3N3O/c15-9-2-1-3-10(16)12(9)13(23)22-8-4-5-20-11(6-8)21-7-14(17,18)19/h1-6H,7H2,(H2,20,21,22,23).
What are the key properties of 2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide?
2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide has a molecular weight of 364.15 g/mol, XLogP of 4.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide is sourced from PubChem (CID 59618340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).