N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide

C17H19ClN2O — CID 43672852

IUPACN-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(NC(C)c2ccccc2Cl)cc1C
InChIInChI=1S/C17H19ClN2O/c1-11-10-14(8-9-17(11)20-13(3)21)19-12(2)15-6-4-5-7-16(15)18/h4-10,12,19H,1-3H3,(H,20,21)
InChIKeyPPUFUSUEZKDUPD-UHFFFAOYSA-N
MW302.81 g/mol
LogP4.78
Rot. Bonds4

About N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide

N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide (PubChem CID 43672852) has the molecular formula C17H19ClN2O and a molecular weight of 302.81 g/mol. Its IUPAC name is N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide
PubChem CID43672852
Molecular FormulaC17H19ClN2O
Molecular Weight302.81 g/mol
Exact Mass302.12
IUPAC NameN-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(NC(C)c2ccccc2Cl)cc1C
InChIInChI=1S/C17H19ClN2O/c1-11-10-14(8-9-17(11)20-13(3)21)19-12(2)15-6-4-5-7-16(15)18/h4-10,12,19H,1-3H3,(H,20,21)
InChIKeyPPUFUSUEZKDUPD-UHFFFAOYSA-N
XLogP4.78
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.81
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-[1-(2-chlorophenyl)ethyl]-4-methylbenzene-1,3-diamine
CID 55132685
N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide
CID 43672879
N-[3-[1-(2,3-dichlorophenyl)ethylamino]phenyl]acetamide
CID 103930892
N-[4-(butan-2-ylamino)-2-methylphenyl]acetamide
CID 43672867
3-[[(1R)-1-(2-chlorophenyl)ethyl]amino]benzamide
CID 28650557
N-[2-methyl-4-(pentan-3-ylamino)phenyl]acetamide
CID 43672883
N-[3-[1-(2-methylphenyl)ethylamino]phenyl]acetamide
CID 43193741
4-bromo-N-[1-(2-chlorophenyl)ethyl]-2-methylaniline
CID 43082336
N-[2-methyl-4-[1-(2-methyl-1,3-thiazol-4-yl)ethylamino]phenyl]acetamide
CID 43672908
3-[1-(2-chlorophenyl)ethylamino]-N-methylbenzamide
CID 43181477
4-acetamido-N-[(1R)-1-(2-chlorophenyl)ethyl]benzamide
CID 27769015
N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide
CID 61334340

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide?
The IUPAC name of N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide (CID 43672852) is N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide.
What is the SMILES notation for N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide?
The canonical SMILES for N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide is CC(=O)Nc1ccc(NC(C)c2ccccc2Cl)cc1C.
What is the InChIKey of N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide?
The InChIKey is PPUFUSUEZKDUPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O/c1-11-10-14(8-9-17(11)20-13(3)21)19-12(2)15-6-4-5-7-16(15)18/h4-10,12,19H,1-3H3,(H,20,21).
What are the key properties of N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide?
N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide has a molecular weight of 302.81 g/mol, XLogP of 4.78, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-(2-chlorophenyl)ethylamino]-2-methylphenyl]acetamide is sourced from PubChem (CID 43672852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).