6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide

C24H19FN4O — CID 67012538

IUPAC6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide
SMILESNC(=O)c1cccc(CC(c2ccc(F)cc2)(c2cccnc2)c2cccnc2)n1
InChIInChI=1S/C24H19FN4O/c25-20-10-8-17(9-11-20)24(18-4-2-12-27-15-18,19-5-3-13-28-16-19)14-21-6-1-7-22(29-21)23(26)30/h1-13,15-16H,14H2,(H2,26,30)
InChIKeyAQVBITWCCGTPSW-UHFFFAOYSA-N
MW398.44 g/mol
LogP3.69
Rot. Bonds6

About 6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide

6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide (PubChem CID 67012538) has the molecular formula C24H19FN4O and a molecular weight of 398.44 g/mol. Its IUPAC name is 6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide
PubChem CID67012538
Molecular FormulaC24H19FN4O
Molecular Weight398.44 g/mol
Exact Mass398.15
IUPAC Name6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide
SMILESNC(=O)c1cccc(CC(c2ccc(F)cc2)(c2cccnc2)c2cccnc2)n1
InChIInChI=1S/C24H19FN4O/c25-20-10-8-17(9-11-20)24(18-4-2-12-27-15-18,19-5-3-13-28-16-19)14-21-6-1-7-22(29-21)23(26)30/h1-13,15-16H,14H2,(H2,26,30)
InChIKeyAQVBITWCCGTPSW-UHFFFAOYSA-N
XLogP3.69
TPSA81.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.44
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Lgh-447
CID 44814409
(3,3-Dimethylpiperidin-1-yl)(6-(3-fluoro-4-methylphenyl)pyridin-2-yl)methanone
CID 24808495
Piberaline
CID 65975
3-Amino-N-(2'-Amino-6'-Methyl[4,4'-Bipyridin]-3-Yl)-6-(2-Fluorophenyl)pyridine-2-Carboxamide
CID 68161871
5-tert-butyl-1-N,3-N-dipyridin-3-ylbenzene-1,3-dicarboxamide
CID 2801003
n-(2-Aminophenyl)-4-{5-[(4-ethylpiperazin-1-yl)methyl]-3-fluoropyridin-2-yl}benzamide
CID 11683474
N-(4-tert-butylphenyl)-4-(3-fluoropyridin-2-yl)benzamide
CID 11152242
3-amino-N-[4-[(3S)-3-aminopiperidin-1-yl]-3-pyridinyl]-6-(2,6-difluorophenyl)pyridine-2-carboxamide
CID 24894053
N-[4-[(1R,3S,5S)-3-amino-5-methylcyclohexyl]-3-pyridinyl]-5-fluoro-6-(2-fluorophenyl)pyridine-2-carboxamide
CID 46179491
N-(4-((1R,3S)-3-aminocyclohexyl)pyridin-3-yl)-6-(2,6-difluorophenyl)-5-fluoropicolinamide
CID 59226389
3-amino-N-[4-(2-amino-4-pyridinyl)-3-pyridinyl]-6-(2-fluorophenyl)pyridine-2-carboxamide
CID 68161034
3-amino-N-[4-(2-amino-6-methyl-4-pyridinyl)-3-pyridinyl]-6-(2,6-difluorophenyl)pyridine-2-carboxamide
CID 68163204

Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide?
The IUPAC name of 6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide (CID 67012538) is 6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide?
The canonical SMILES for 6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide is NC(=O)c1cccc(CC(c2ccc(F)cc2)(c2cccnc2)c2cccnc2)n1.
What is the InChIKey of 6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide?
The InChIKey is AQVBITWCCGTPSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19FN4O/c25-20-10-8-17(9-11-20)24(18-4-2-12-27-15-18,19-5-3-13-28-16-19)14-21-6-1-7-22(29-21)23(26)30/h1-13,15-16H,14H2,(H2,26,30).
What are the key properties of 6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide?
6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide has a molecular weight of 398.44 g/mol, XLogP of 3.69, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-fluorophenyl)-2,2-dipyridin-3-ylethyl]pyridine-2-carboxamide is sourced from PubChem (CID 67012538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).