N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide

C18H21Cl2N3O — CID 4880486

IUPACN-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide
SMILESCN(C)CCNC(C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1
InChIInChI=1S/C18H21Cl2N3O/c1-23(2)9-8-21-17(13-6-4-3-5-7-13)18(24)22-16-11-14(19)10-15(20)12-16/h3-7,10-12,17,21H,8-9H2,1-2H3,(H,22,24)
InChIKeySDWMHFRLYBCUOT-UHFFFAOYSA-N
MW366.29 g/mol
LogP3.82
Rot. Bonds7

About N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide

N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide (PubChem CID 4880486) has the molecular formula C18H21Cl2N3O and a molecular weight of 366.29 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide
PubChem CID4880486
Molecular FormulaC18H21Cl2N3O
Molecular Weight366.29 g/mol
Exact Mass365.11
IUPAC NameN-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide
SMILESCN(C)CCNC(C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1
InChIInChI=1S/C18H21Cl2N3O/c1-23(2)9-8-21-17(13-6-4-3-5-7-13)18(24)22-16-11-14(19)10-15(20)12-16/h3-7,10-12,17,21H,8-9H2,1-2H3,(H,22,24)
InChIKeySDWMHFRLYBCUOT-UHFFFAOYSA-N
XLogP3.82
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.29
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide?
The IUPAC name of N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide (CID 4880486) is N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide is CN(C)CCNC(C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1.
What is the InChIKey of N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide?
The InChIKey is SDWMHFRLYBCUOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21Cl2N3O/c1-23(2)9-8-21-17(13-6-4-3-5-7-13)18(24)22-16-11-14(19)10-15(20)12-16/h3-7,10-12,17,21H,8-9H2,1-2H3,(H,22,24).
What are the key properties of N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide?
N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide has a molecular weight of 366.29 g/mol, XLogP of 3.82, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]-2-phenylacetamide is sourced from PubChem (CID 4880486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).