2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide

C21H17Cl2N3O4 — CID 1342446

IUPAC2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide
SMILESO=C(COc1ccccc1Cl)Nc1cccc(NC(=O)COc2ccccc2Cl)n1
InChIInChI=1S/C21H17Cl2N3O4/c22-14-6-1-3-8-16(14)29-12-20(27)25-18-10-5-11-19(24-18)26-21(28)13-30-17-9-4-2-7-15(17)23/h1-11H,12-13H2,(H2,24,25,26,27,28)
InChIKeyXXCUFLOVXDCSAX-UHFFFAOYSA-N
MW446.29 g/mol
LogP4.42
Rot. Bonds8

About 2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide

2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide (PubChem CID 1342446) has the molecular formula C21H17Cl2N3O4 and a molecular weight of 446.29 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide
PubChem CID1342446
Molecular FormulaC21H17Cl2N3O4
Molecular Weight446.29 g/mol
Exact Mass445.06
IUPAC Name2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide
SMILESO=C(COc1ccccc1Cl)Nc1cccc(NC(=O)COc2ccccc2Cl)n1
InChIInChI=1S/C21H17Cl2N3O4/c22-14-6-1-3-8-16(14)29-12-20(27)25-18-10-5-11-19(24-18)26-21(28)13-30-17-9-4-2-7-15(17)23/h1-11H,12-13H2,(H2,24,25,26,27,28)
InChIKeyXXCUFLOVXDCSAX-UHFFFAOYSA-N
XLogP4.42
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.29
LogP ≤ 54.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-chlorophenoxy)-N-[2-[[2-(2-chlorophenoxy)acetyl]amino]phenyl]acetamide
CID 1032604
2-(2-chlorophenoxy)-N-phenylacetamide
CID 853450
2-(2-chlorophenoxy)-N-pyridin-4-ylacetamide
CID 21229438
2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 707255
2-(2-chlorophenoxy)-N-hydroxyacetamide
CID 95562486
2-(2-chlorophenoxy)-N-quinolin-8-ylacetamide
CID 952634
2-(2-chlorophenoxy)-N-(6-chloro-3-pyridinyl)acetamide
CID 54787980
2-(2-chlorophenoxy)-N-(3-hydroxy-2-pyridinyl)acetamide
CID 18109429
2-(2-chlorophenoxy)-N-(3-chlorophenyl)acetamide
CID 707250
2-(4-chlorophenoxy)-N-[6-[[2-(4-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide
CID 1012475
2-(2-chlorophenoxy)-N-(4-phenylphenyl)acetamide
CID 7926033
N-[3-[[2-(2-chlorophenoxy)acetyl]amino]phenyl]propanamide
CID 17027266

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide (CID 1342446) is 2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide is O=C(COc1ccccc1Cl)Nc1cccc(NC(=O)COc2ccccc2Cl)n1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide?
The InChIKey is XXCUFLOVXDCSAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17Cl2N3O4/c22-14-6-1-3-8-16(14)29-12-20(27)25-18-10-5-11-19(24-18)26-21(28)13-30-17-9-4-2-7-15(17)23/h1-11H,12-13H2,(H2,24,25,26,27,28).
What are the key properties of 2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide?
2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide has a molecular weight of 446.29 g/mol, XLogP of 4.42, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide is sourced from PubChem (CID 1342446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).