N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide

C18H21ClN2O — CID 71933759

IUPACN-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide
SMILESCCN(C)C(C(=O)NCc1ccc(Cl)cc1)c1ccccc1
InChIInChI=1S/C18H21ClN2O/c1-3-21(2)17(15-7-5-4-6-8-15)18(22)20-13-14-9-11-16(19)12-10-14/h4-12,17H,3,13H2,1-2H3,(H,20,22)
InChIKeyWAEYGHIAANSRHR-UHFFFAOYSA-N
MW316.83 g/mol
LogP3.65
Rot. Bonds6

About N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide

N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide (PubChem CID 71933759) has the molecular formula C18H21ClN2O and a molecular weight of 316.83 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide
PubChem CID71933759
Molecular FormulaC18H21ClN2O
Molecular Weight316.83 g/mol
Exact Mass316.13
IUPAC NameN-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide
SMILESCCN(C)C(C(=O)NCc1ccc(Cl)cc1)c1ccccc1
InChIInChI=1S/C18H21ClN2O/c1-3-21(2)17(15-7-5-4-6-8-15)18(22)20-13-14-9-11-16(19)12-10-14/h4-12,17H,3,13H2,1-2H3,(H,20,22)
InChIKeyWAEYGHIAANSRHR-UHFFFAOYSA-N
XLogP3.65
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.83
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-chlorophenyl)methyl]-2-[methyl(methylsulfonyl)amino]-2-phenylacetamide
CID 133160999
N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-2-(dimethylamino)-2-phenylacetamide
CID 110625358
N-(2-aminoethyl)-2-[ethyl(methyl)amino]-2-phenylacetamide
CID 119384601
2-(diethylamino)-N-[(4-fluorophenyl)methyl]-2-phenylacetamide
CID 56538273
2-[acetyl-[(4-chlorophenyl)methyl]amino]-2-phenyl-N-(pyridin-4-ylmethyl)acetamide
CID 133237321
(2R)-N-[[6-(dimethylamino)-3-pyridinyl]methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide
CID 94750528
N-[(4-chlorophenyl)methyl]-2-[(4-chlorophenyl)methyl-[2-[methyl(methylsulfonyl)amino]acetyl]amino]-2-phenylacetamide
CID 133237535
4-[[[2-(diethylamino)-2-phenylacetyl]amino]methyl]benzoic acid
CID 119353551
N-[(4-chlorophenyl)methyl]-2,3,3-triphenylpropanamide
CID 19165627
2-[ethyl(methyl)amino]-2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]acetamide
CID 56521548
N-benzyl-2,2-bis(4-chlorophenyl)acetamide
CID 1144143
3-amino-N-benzyl-2-[2-(4-chlorophenyl)ethyl-ethylamino]propanamide
CID 70138919

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide (CID 71933759) is N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide is CCN(C)C(C(=O)NCc1ccc(Cl)cc1)c1ccccc1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide?
The InChIKey is WAEYGHIAANSRHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN2O/c1-3-21(2)17(15-7-5-4-6-8-15)18(22)20-13-14-9-11-16(19)12-10-14/h4-12,17H,3,13H2,1-2H3,(H,20,22).
What are the key properties of N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide?
N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide has a molecular weight of 316.83 g/mol, XLogP of 3.65, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide is sourced from PubChem (CID 71933759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).