2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide

C17H18Cl2N2O2 — CID 109009437

IUPAC2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide
SMILESCC(C)Oc1ccc(NC(=O)CNc2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C17H18Cl2N2O2/c1-11(2)23-13-8-6-12(7-9-13)21-16(22)10-20-17-14(18)4-3-5-15(17)19/h3-9,11,20H,10H2,1-2H3,(H,21,22)
InChIKeyABQRGTVJTGJXLC-UHFFFAOYSA-N
MW353.25 g/mol
LogP4.83
Rot. Bonds6

About 2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide

2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide (PubChem CID 109009437) has the molecular formula C17H18Cl2N2O2 and a molecular weight of 353.25 g/mol. Its IUPAC name is 2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide
PubChem CID109009437
Molecular FormulaC17H18Cl2N2O2
Molecular Weight353.25 g/mol
Exact Mass352.07
IUPAC Name2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide
SMILESCC(C)Oc1ccc(NC(=O)CNc2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C17H18Cl2N2O2/c1-11(2)23-13-8-6-12(7-9-13)21-16(22)10-20-17-14(18)4-3-5-15(17)19/h3-9,11,20H,10H2,1-2H3,(H,21,22)
InChIKeyABQRGTVJTGJXLC-UHFFFAOYSA-N
XLogP4.83
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.25
LogP ≤ 54.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,6-diethylanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 109008014
2-(3-chloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 54809371
2-(3-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 54829870
2-(4-acetamidoanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 54809144
2-[2-(2,6-dichloroanilino)phenyl]-N-(4-propan-2-yloxyphenyl)acetamide
CID 54789933
N-[4-[[2-(4-propan-2-yloxyanilino)acetyl]amino]phenyl]propanamide
CID 54822614
2-(3-methylanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 39419759
N-(4-chlorophenyl)-2-(3-propan-2-yloxyanilino)acetamide
CID 54829967
2-(2,6-dichloroanilino)-N-(4-fluorophenyl)acetamide
CID 65469582
2-(2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 54828741
3-methyl-N-[4-[[2-(4-propan-2-yloxyanilino)acetyl]amino]phenyl]benzamide
CID 54822485
2-(2-chloroanilino)-N-(3-propan-2-yloxyphenyl)acetamide
CID 54810243

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide?
The IUPAC name of 2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide (CID 109009437) is 2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide.
What is the SMILES notation for 2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide?
The canonical SMILES for 2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide is CC(C)Oc1ccc(NC(=O)CNc2c(Cl)cccc2Cl)cc1.
What is the InChIKey of 2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide?
The InChIKey is ABQRGTVJTGJXLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2O2/c1-11(2)23-13-8-6-12(7-9-13)21-16(22)10-20-17-14(18)4-3-5-15(17)19/h3-9,11,20H,10H2,1-2H3,(H,21,22).
What are the key properties of 2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide?
2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide has a molecular weight of 353.25 g/mol, XLogP of 4.83, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide is sourced from PubChem (CID 109009437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).