N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide

C24H21N5O — CID 67011187

IUPACN-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cccc(CC(c2cccnc2)(c2cccnc2)c2ccccn2)n1
InChIInChI=1S/C24H21N5O/c1-18(30)28-23-11-4-9-21(29-23)15-24(19-7-5-12-25-16-19,20-8-6-13-26-17-20)22-10-2-3-14-27-22/h2-14,16-17H,15H2,1H3,(H,28,29,30)
InChIKeyQHVRZFBVDWCYAU-UHFFFAOYSA-N
MW395.47 g/mol
LogP3.80
Rot. Bonds6

About N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide

N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide (PubChem CID 67011187) has the molecular formula C24H21N5O and a molecular weight of 395.47 g/mol. Its IUPAC name is N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide
PubChem CID67011187
Molecular FormulaC24H21N5O
Molecular Weight395.47 g/mol
Exact Mass395.17
IUPAC NameN-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cccc(CC(c2cccnc2)(c2cccnc2)c2ccccn2)n1
InChIInChI=1S/C24H21N5O/c1-18(30)28-23-11-4-9-21(29-23)15-24(19-7-5-12-25-16-19,20-8-6-13-26-17-20)22-10-2-3-14-27-22/h2-14,16-17H,15H2,1H3,(H,28,29,30)
InChIKeyQHVRZFBVDWCYAU-UHFFFAOYSA-N
XLogP3.80
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.47
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide?
The IUPAC name of N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide (CID 67011187) is N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide.
What is the SMILES notation for N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide?
The canonical SMILES for N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide is CC(=O)Nc1cccc(CC(c2cccnc2)(c2cccnc2)c2ccccn2)n1.
What is the InChIKey of N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide?
The InChIKey is QHVRZFBVDWCYAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N5O/c1-18(30)28-23-11-4-9-21(29-23)15-24(19-7-5-12-25-16-19,20-8-6-13-26-17-20)22-10-2-3-14-27-22/h2-14,16-17H,15H2,1H3,(H,28,29,30).
What are the key properties of N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide?
N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide has a molecular weight of 395.47 g/mol, XLogP of 3.80, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]acetamide is sourced from PubChem (CID 67011187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).