2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide

C18H20Cl2N2O2 — CID 54813306

IUPAC2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
SMILESCC(C)COc1ccccc1NC(=O)CNc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C18H20Cl2N2O2/c1-12(2)11-24-17-6-4-3-5-16(17)22-18(23)10-21-15-8-13(19)7-14(20)9-15/h3-9,12,21H,10-11H2,1-2H3,(H,22,23)
InChIKeyLNWRBQPFDIUVJQ-UHFFFAOYSA-N
MW367.28 g/mol
LogP5.08
Rot. Bonds7

About 2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide

2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide (PubChem CID 54813306) has the molecular formula C18H20Cl2N2O2 and a molecular weight of 367.28 g/mol. Its IUPAC name is 2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
PubChem CID54813306
Molecular FormulaC18H20Cl2N2O2
Molecular Weight367.28 g/mol
Exact Mass366.09
IUPAC Name2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
SMILESCC(C)COc1ccccc1NC(=O)CNc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C18H20Cl2N2O2/c1-12(2)11-24-17-6-4-3-5-16(17)22-18(23)10-21-15-8-13(19)7-14(20)9-15/h3-9,12,21H,10-11H2,1-2H3,(H,22,23)
InChIKeyLNWRBQPFDIUVJQ-UHFFFAOYSA-N
XLogP5.08
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.28
LogP ≤ 55.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dimethylanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54811574
2-(2-methoxyanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54817214
2-(3-chloro-2-methylanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54812960
2-methyl-N-[3-[[2-[2-(2-methylpropoxy)anilino]-2-oxoethyl]amino]phenyl]propanamide
CID 54831517
2-(3,5-dichloroanilino)-N-[2-(3-phenylpropoxy)phenyl]acetamide
CID 54813100
3-[[2-[2-(2-methylpropoxy)anilino]-2-oxoethyl]amino]-N-propan-2-ylbenzamide
CID 54833609
2-(2,3-dimethylanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54815991
2-(4-chloro-2-methylphenoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 17074239
N-(2-methoxyphenyl)-2-[3-(2-methylpropoxy)anilino]acetamide
CID 54823826
N-[4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]phenyl]propanamide
CID 54823688
N-(2-chlorophenyl)-2-(3,5-dichloroanilino)acetamide
CID 26417607
N-(2-butoxyphenyl)-2-[4-(2-methylpropoxy)anilino]acetamide
CID 54820437

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide?
The IUPAC name of 2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide (CID 54813306) is 2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide.
What is the SMILES notation for 2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide?
The canonical SMILES for 2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide is CC(C)COc1ccccc1NC(=O)CNc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide?
The InChIKey is LNWRBQPFDIUVJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20Cl2N2O2/c1-12(2)11-24-17-6-4-3-5-16(17)22-18(23)10-21-15-8-13(19)7-14(20)9-15/h3-9,12,21H,10-11H2,1-2H3,(H,22,23).
What are the key properties of 2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide?
2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide has a molecular weight of 367.28 g/mol, XLogP of 5.08, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichloroanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide is sourced from PubChem (CID 54813306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).