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

C14H13Cl2N3O — CID 59618587

IUPAC2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide
SMILESCN(C)c1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
InChIInChI=1S/C14H13Cl2N3O/c1-19(2)12-8-9(6-7-17-12)18-14(20)13-10(15)4-3-5-11(13)16/h3-8H,1-2H3,(H,17,18,20)
InChIKeyGKLIRDLXWUCLKI-UHFFFAOYSA-N
MW310.18 g/mol
LogP3.71
Rot. Bonds3

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

2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide (PubChem CID 59618587) has the molecular formula C14H13Cl2N3O and a molecular weight of 310.18 g/mol. Its IUPAC name is 2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide
PubChem CID59618587
Molecular FormulaC14H13Cl2N3O
Molecular Weight310.18 g/mol
Exact Mass309.04
IUPAC Name2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide
SMILESCN(C)c1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
InChIInChI=1S/C14H13Cl2N3O/c1-19(2)12-8-9(6-7-17-12)18-14(20)13-10(15)4-3-5-11(13)16/h3-8H,1-2H3,(H,17,18,20)
InChIKeyGKLIRDLXWUCLKI-UHFFFAOYSA-N
XLogP3.71
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dichloro-N-[2-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]-4-pyridinyl]benzamide
CID 68672269
2,6-dichloro-N-[2-[[5-(dimethylamino)-2-pyridinyl]amino]-4-pyridinyl]benzamide
CID 59618178
2,6-dichloro-N-[2-[[2-(dimethylamino)-6-methylpyrimidin-4-yl]amino]-4-pyridinyl]benzamide
CID 68672392
3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide
CID 154749790
2,6-dichloro-N-[2-(cyclobutanecarbonylamino)-4-pyridinyl]benzamide
CID 59618171
2,6-dichloro-N-[2-[[(1R,2S)-2-methylcyclopropanecarbonyl]amino]-4-pyridinyl]benzamide
CID 59618440
2-chloro-6-methyl-N-pyridin-4-ylbenzamide
CID 59618146
2,6-dichloro-N-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]benzamide
CID 59618340
2,6-dichloro-N-[2-[(2-cyanoacetyl)amino]-4-pyridinyl]benzamide
CID 59618360
2,6-dichloro-N-[2-[[2-(methylamino)-6-(trifluoromethyl)pyrimidin-4-yl]amino]-4-pyridinyl]benzamide
CID 68672351
methyl 6-[[4-[(2,6-dichlorobenzoyl)amino]-2-pyridinyl]amino]pyridine-2-carboxylate
CID 59617969
2,6-dichloro-N-[2-[[(1R,2S)-2-fluorocyclopropanecarbonyl]amino]-4-pyridinyl]benzamide
CID 59618118

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide?
The IUPAC name of 2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide (CID 59618587) is 2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide is CN(C)c1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1.
What is the InChIKey of 2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide?
The InChIKey is GKLIRDLXWUCLKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2N3O/c1-19(2)12-8-9(6-7-17-12)18-14(20)13-10(15)4-3-5-11(13)16/h3-8H,1-2H3,(H,17,18,20).
What are the key properties of 2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide?
2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide has a molecular weight of 310.18 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide is sourced from PubChem (CID 59618587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).