N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide

C20H16Cl2N4O2 — CID 162746510

IUPACN-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide
SMILESCC(=O)N(c1ccncc1)c1cc(NC(=O)Cc2c(Cl)cccc2Cl)ccn1
InChIInChI=1S/C20H16Cl2N4O2/c1-13(27)26(15-6-8-23-9-7-15)19-11-14(5-10-24-19)25-20(28)12-16-17(21)3-2-4-18(16)22/h2-11H,12H2,1H3,(H,24,25,28)
InChIKeyBIYUDWBAPJAFFO-UHFFFAOYSA-N
MW415.28 g/mol
LogP4.65
Rot. Bonds5

About N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide

N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide (PubChem CID 162746510) has the molecular formula C20H16Cl2N4O2 and a molecular weight of 415.28 g/mol. Its IUPAC name is N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide.

Molecular Properties

Compound NameN-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide
PubChem CID162746510
Molecular FormulaC20H16Cl2N4O2
Molecular Weight415.28 g/mol
Exact Mass414.07
IUPAC NameN-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide
SMILESCC(=O)N(c1ccncc1)c1cc(NC(=O)Cc2c(Cl)cccc2Cl)ccn1
InChIInChI=1S/C20H16Cl2N4O2/c1-13(27)26(15-6-8-23-9-7-15)19-11-14(5-10-24-19)25-20(28)12-16-17(21)3-2-4-18(16)22/h2-11H,12H2,1H3,(H,24,25,28)
InChIKeyBIYUDWBAPJAFFO-UHFFFAOYSA-N
XLogP4.65
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.28
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide?
The IUPAC name of N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide (CID 162746510) is N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide.
What is the SMILES notation for N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide?
The canonical SMILES for N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide is CC(=O)N(c1ccncc1)c1cc(NC(=O)Cc2c(Cl)cccc2Cl)ccn1.
What is the InChIKey of N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide?
The InChIKey is BIYUDWBAPJAFFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16Cl2N4O2/c1-13(27)26(15-6-8-23-9-7-15)19-11-14(5-10-24-19)25-20(28)12-16-17(21)3-2-4-18(16)22/h2-11H,12H2,1H3,(H,24,25,28).
What are the key properties of N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide?
N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide has a molecular weight of 415.28 g/mol, XLogP of 4.65, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide is sourced from PubChem (CID 162746510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).