N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide

C17H19ClN2O — CID 108996571

IUPACN-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide
SMILESCc1ccccc1CNCC(=O)Nc1ccc(Cl)cc1C
InChIInChI=1S/C17H19ClN2O/c1-12-5-3-4-6-14(12)10-19-11-17(21)20-16-8-7-15(18)9-13(16)2/h3-9,19H,10-11H2,1-2H3,(H,20,21)
InChIKeyOLCBIRDPWKIDNH-UHFFFAOYSA-N
MW302.81 g/mol
LogP3.69
Rot. Bonds5

About N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide

N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide (PubChem CID 108996571) has the molecular formula C17H19ClN2O and a molecular weight of 302.81 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide
PubChem CID108996571
Molecular FormulaC17H19ClN2O
Molecular Weight302.81 g/mol
Exact Mass302.12
IUPAC NameN-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide
SMILESCc1ccccc1CNCC(=O)Nc1ccc(Cl)cc1C
InChIInChI=1S/C17H19ClN2O/c1-12-5-3-4-6-14(12)10-19-11-17(21)20-16-8-7-15(18)9-13(16)2/h3-9,19H,10-11H2,1-2H3,(H,20,21)
InChIKeyOLCBIRDPWKIDNH-UHFFFAOYSA-N
XLogP3.69
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.81
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,4-dichlorophenyl)-2-[(2-methylphenyl)methylamino]acetamide
CID 108996624
N'-(4-chloro-2-methylphenyl)-N-[(2-methylphenyl)methyl]propanediamide
CID 108945452
N-(3-chloro-4-fluorophenyl)-2-[(2-methylphenyl)methylamino]acetamide
CID 108996573
N-(2,4-dichlorophenyl)-3-[(2-methylphenyl)methylamino]propanamide
CID 109019394
N-(4-chloro-2-methylphenyl)-2-(furan-2-ylmethylamino)acetamide
CID 108996274
N-(5-chloro-2-methylphenyl)-2-(2-methylphenyl)acetamide
CID 8624306
1-(4-chloro-2-methylphenyl)-3-(2-methylphenyl)urea
CID 108894172
N-(2,6-dichlorophenyl)-2-[(2-methylphenyl)methylamino]acetamide
CID 60695302
1-(4-chloro-2-methylphenyl)-N-[(2-methylphenyl)methyl]methanamine
CID 104853852
2-(4-chloroanilino)-N-(4-chloro-2-methylphenyl)acetamide
CID 26506560
N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]pyrimidine-5-carboxamide
CID 109255747
N-benzyl-2-[(4-chloro-2-methylphenyl)methylamino]acetamide
CID 104853952

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide (CID 108996571) is N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide is Cc1ccccc1CNCC(=O)Nc1ccc(Cl)cc1C.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide?
The InChIKey is OLCBIRDPWKIDNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O/c1-12-5-3-4-6-14(12)10-19-11-17(21)20-16-8-7-15(18)9-13(16)2/h3-9,19H,10-11H2,1-2H3,(H,20,21).
What are the key properties of N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide?
N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide has a molecular weight of 302.81 g/mol, XLogP of 3.69, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide is sourced from PubChem (CID 108996571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).