2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide

C15H14Cl2N2O — CID 60790039

IUPAC2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide
SMILESNC(=O)Cc1ccc(NCc2cc(Cl)cc(Cl)c2)cc1
InChIInChI=1S/C15H14Cl2N2O/c16-12-5-11(6-13(17)8-12)9-19-14-3-1-10(2-4-14)7-15(18)20/h1-6,8,19H,7,9H2,(H2,18,20)
InChIKeyPKCZMHDPVMYUCN-UHFFFAOYSA-N
MW309.20 g/mol
LogP3.63
Rot. Bonds5

About 2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide

2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide (PubChem CID 60790039) has the molecular formula C15H14Cl2N2O and a molecular weight of 309.20 g/mol. Its IUPAC name is 2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide.

Molecular Properties

Compound Name2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide
PubChem CID60790039
Molecular FormulaC15H14Cl2N2O
Molecular Weight309.20 g/mol
Exact Mass308.05
IUPAC Name2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide
SMILESNC(=O)Cc1ccc(NCc2cc(Cl)cc(Cl)c2)cc1
InChIInChI=1S/C15H14Cl2N2O/c16-12-5-11(6-13(17)8-12)9-19-14-3-1-10(2-4-14)7-15(18)20/h1-6,8,19H,7,9H2,(H2,18,20)
InChIKeyPKCZMHDPVMYUCN-UHFFFAOYSA-N
XLogP3.63
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.20
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]acetamide
CID 103844946
2-[4-[(2-bromo-5-chlorophenyl)methylamino]phenyl]acetamide
CID 66160120
2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide
CID 43724073
2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide
CID 43786878
2-[4-(naphthalen-2-ylmethylamino)phenyl]acetamide
CID 174611975
2-[4-[(3-hydroxyphenyl)methylamino]phenyl]acetamide
CID 43724140
2-[4-[[4-(dimethylamino)phenyl]methylamino]phenyl]acetamide
CID 43724056
N-[4-[(3,5-dichlorophenyl)methylamino]phenyl]propanamide
CID 60790033
2-[4-[(2,4,5-trimethylphenyl)methylamino]phenyl]acetamide
CID 43786872
2-[4-[(2,4,6-trimethylphenyl)methylamino]phenyl]acetamide
CID 43724074
2-[4-[(4-nitrophenyl)methylamino]phenyl]acetamide
CID 43724024
2-[(3,5-dichlorophenyl)methylamino]oxyacetamide
CID 112672702

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide?
The IUPAC name of 2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide (CID 60790039) is 2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide.
What is the SMILES notation for 2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide?
The canonical SMILES for 2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide is NC(=O)Cc1ccc(NCc2cc(Cl)cc(Cl)c2)cc1.
What is the InChIKey of 2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide?
The InChIKey is PKCZMHDPVMYUCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O/c16-12-5-11(6-13(17)8-12)9-19-14-3-1-10(2-4-14)7-15(18)20/h1-6,8,19H,7,9H2,(H2,18,20).
What are the key properties of 2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide?
2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide has a molecular weight of 309.20 g/mol, XLogP of 3.63, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide is sourced from PubChem (CID 60790039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).