N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide

C18H22N2O — CID 43193742

IUPACN-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide
SMILESCC(=O)Nc1cccc(NC(C)c2ccc(C)cc2C)c1
InChIInChI=1S/C18H22N2O/c1-12-8-9-18(13(2)10-12)14(3)19-16-6-5-7-17(11-16)20-15(4)21/h5-11,14,19H,1-4H3,(H,20,21)
InChIKeyBVOREDBVEOSHSF-UHFFFAOYSA-N
MW282.39 g/mol
LogP4.43
Rot. Bonds4

About N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide

N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide (PubChem CID 43193742) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide
PubChem CID43193742
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC NameN-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide
SMILESCC(=O)Nc1cccc(NC(C)c2ccc(C)cc2C)c1
InChIInChI=1S/C18H22N2O/c1-12-8-9-18(13(2)10-12)14(3)19-16-6-5-7-17(11-16)20-15(4)21/h5-11,14,19H,1-4H3,(H,20,21)
InChIKeyBVOREDBVEOSHSF-UHFFFAOYSA-N
XLogP4.43
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-[1-(2-methylphenyl)ethylamino]phenyl]acetamide
CID 43193741
1-[(1S)-1-(2,4-dimethylphenyl)ethyl]-3-(3-methylphenyl)urea
CID 27474756
[3-[1-(2-hydroxy-4-methylphenyl)ethylamino]phenyl]urea
CID 43744448
1-(3-acetylphenyl)-3-[1-(2,4-dimethylphenyl)ethyl]urea
CID 45153652
N-[3-[1-(3,4-dimethylphenyl)ethylamino]phenyl]acetamide
CID 43193756
N-[3-[1-(2,3-dichlorophenyl)ethylamino]phenyl]acetamide
CID 103930892
N-[1-(2,4-dimethylphenyl)ethyl]acetamide
CID 17327567
1-(3-acetylphenyl)-3-[1-(2,4-dimethylphenyl)ethyl]thiourea
CID 19675250
N-[3-[1-(2-methoxyphenyl)ethylamino]phenyl]acetamide
CID 43193717
N-[3-(1-phenylethylamino)phenyl]acetamide
CID 43178472
acetic acid;N-[3-(propan-2-ylamino)phenyl]acetamide
CID 174839462
N-[3-[1-(5-methylfuran-2-yl)ethylamino]phenyl]acetamide
CID 43193733

Frequently Asked Questions

What is the IUPAC name of N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide?
The IUPAC name of N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide (CID 43193742) is N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide.
What is the SMILES notation for N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide?
The canonical SMILES for N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide is CC(=O)Nc1cccc(NC(C)c2ccc(C)cc2C)c1.
What is the InChIKey of N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide?
The InChIKey is BVOREDBVEOSHSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-12-8-9-18(13(2)10-12)14(3)19-16-6-5-7-17(11-16)20-15(4)21/h5-11,14,19H,1-4H3,(H,20,21).
What are the key properties of N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide?
N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide has a molecular weight of 282.39 g/mol, XLogP of 4.43, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide is sourced from PubChem (CID 43193742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).