N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide

C19H23ClN2O — CID 108997968

IUPACN-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide
SMILESCC(C)(C)c1ccccc1NC(=O)CNCc1ccccc1Cl
InChIInChI=1S/C19H23ClN2O/c1-19(2,3)15-9-5-7-11-17(15)22-18(23)13-21-12-14-8-4-6-10-16(14)20/h4-11,21H,12-13H2,1-3H3,(H,22,23)
InChIKeyRHRGXZUJKJPEBZ-UHFFFAOYSA-N
MW330.86 g/mol
LogP4.37
Rot. Bonds5

About N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide

N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide (PubChem CID 108997968) has the molecular formula C19H23ClN2O and a molecular weight of 330.86 g/mol. Its IUPAC name is N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide
PubChem CID108997968
Molecular FormulaC19H23ClN2O
Molecular Weight330.86 g/mol
Exact Mass330.15
IUPAC NameN-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide
SMILESCC(C)(C)c1ccccc1NC(=O)CNCc1ccccc1Cl
InChIInChI=1S/C19H23ClN2O/c1-19(2,3)15-9-5-7-11-17(15)22-18(23)13-21-12-14-8-4-6-10-16(14)20/h4-11,21H,12-13H2,1-3H3,(H,22,23)
InChIKeyRHRGXZUJKJPEBZ-UHFFFAOYSA-N
XLogP4.37
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.86
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-tert-butylphenyl)-2-(prop-2-ynylamino)acetamide
CID 78912848
2-[(2-chlorophenyl)methylamino]-N-naphthalen-1-ylacetamide
CID 3974047
N-(2-tert-butylphenyl)-2-(3-chloro-2-methylanilino)acetamide
CID 109008221
N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide
CID 7920165
N-[2-(2-tert-butylanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 112997518
2-[(2-chlorophenyl)methylamino]-N-(2,6-dichlorophenyl)acetamide
CID 43405213
N-(2-tert-butylphenyl)-2-[2-(dimethylamino)ethylamino]acetamide
CID 108994503
N-(2-tert-butylphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914752
N-(2-tert-butylphenyl)-N'-(2,6-dichlorophenyl)propanediamide
CID 108954677
N-(2-tert-butylphenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide
CID 109281939
2-[(2-chlorophenyl)methylamino]-N-(3,5-dichlorophenyl)acetamide
CID 54832861
N-[2-(2-tert-butylanilino)-2-oxoethyl]-4-chlorobenzamide
CID 112997506

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide?
The IUPAC name of N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide (CID 108997968) is N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide.
What is the SMILES notation for N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide?
The canonical SMILES for N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide is CC(C)(C)c1ccccc1NC(=O)CNCc1ccccc1Cl.
What is the InChIKey of N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide?
The InChIKey is RHRGXZUJKJPEBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O/c1-19(2,3)15-9-5-7-11-17(15)22-18(23)13-21-12-14-8-4-6-10-16(14)20/h4-11,21H,12-13H2,1-3H3,(H,22,23).
What are the key properties of N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide?
N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide has a molecular weight of 330.86 g/mol, XLogP of 4.37, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide is sourced from PubChem (CID 108997968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).