2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide

C14H11Cl3N2O — CID 54809235

IUPAC2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide
SMILESO=C(CNc1cccc(Cl)c1)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H11Cl3N2O/c15-9-2-1-3-12(5-9)18-8-14(20)19-13-6-10(16)4-11(17)7-13/h1-7,18H,8H2,(H,19,20)
InChIKeyJBYDUHVSROCZQV-UHFFFAOYSA-N
MW329.61 g/mol
LogP4.70
Rot. Bonds4

About 2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide

2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide (PubChem CID 54809235) has the molecular formula C14H11Cl3N2O and a molecular weight of 329.61 g/mol. Its IUPAC name is 2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide
PubChem CID54809235
Molecular FormulaC14H11Cl3N2O
Molecular Weight329.61 g/mol
Exact Mass327.99
IUPAC Name2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide
SMILESO=C(CNc1cccc(Cl)c1)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H11Cl3N2O/c15-9-2-1-3-12(5-9)18-8-14(20)19-13-6-10(16)4-11(17)7-13/h1-7,18H,8H2,(H,19,20)
InChIKeyJBYDUHVSROCZQV-UHFFFAOYSA-N
XLogP4.70
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.61
LogP ≤ 54.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chlorophenyl)-2-(naphthalen-2-ylamino)acetamide
CID 9082694
N-[3-[[2-(3-chloroanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54809062
N-[4-[[2-(3-chloroanilino)acetyl]amino]phenyl]-3-methylbutanamide
CID 54809091
2-(3-chloroanilino)-N-[4-(dimethylamino)phenyl]acetamide
CID 109008440
2-(4-bromo-3-chloroanilino)-N-(3-chlorophenyl)acetamide
CID 107619813
2-(3-chloroanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 9098819
N-[4-[[2-(3-chloroanilino)-2-oxoethyl]amino]phenyl]propanamide
CID 54835550
3-[[2-(3,5-dichloroanilino)-2-oxoethyl]amino]-N,N-diethylbenzamide
CID 54832743
N-(3,5-dichlorophenyl)-2-[3-(2-methoxyethoxy)anilino]acetamide
CID 54829747
N-(3,5-dichlorophenyl)-2-(2,6-difluoroanilino)acetamide
CID 109011204
3-[[2-(3,5-dichloroanilino)-2-oxoethyl]amino]-N-propylbenzamide
CID 54838861
2-(2-chloroanilino)-N-(3,5-dichlorophenyl)acetamide
CID 54810505

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide?
The IUPAC name of 2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide (CID 54809235) is 2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide?
The canonical SMILES for 2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide is O=C(CNc1cccc(Cl)c1)Nc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide?
The InChIKey is JBYDUHVSROCZQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl3N2O/c15-9-2-1-3-12(5-9)18-8-14(20)19-13-6-10(16)4-11(17)7-13/h1-7,18H,8H2,(H,19,20).
What are the key properties of 2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide?
2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide has a molecular weight of 329.61 g/mol, XLogP of 4.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide is sourced from PubChem (CID 54809235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).