2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide

C18H22N2O — CID 81312311

IUPAC2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide
SMILESCc1ccccc1C(C)NC(=O)Cc1ccccc1CN
InChIInChI=1S/C18H22N2O/c1-13-7-3-6-10-17(13)14(2)20-18(21)11-15-8-4-5-9-16(15)12-19/h3-10,14H,11-12,19H2,1-2H3,(H,20,21)
InChIKeyOADILYJWSUAQMP-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.87
Rot. Bonds5

About 2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide

2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide (PubChem CID 81312311) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide
PubChem CID81312311
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide
SMILESCc1ccccc1C(C)NC(=O)Cc1ccccc1CN
InChIInChI=1S/C18H22N2O/c1-13-7-3-6-10-17(13)14(2)20-18(21)11-15-8-4-5-9-16(15)12-19/h3-10,14H,11-12,19H2,1-2H3,(H,20,21)
InChIKeyOADILYJWSUAQMP-UHFFFAOYSA-N
XLogP2.87
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-fluorophenyl)-N-[1-(2-methylphenyl)ethyl]acetamide
CID 18082306
3-amino-N-[(1S)-1-(2-methylphenyl)ethyl]propanamide
CID 81380300
N-[1-(2-methylphenyl)ethyl]-2-phenylacetamide
CID 59082083
4-amino-3-methyl-N-[1-(2-methylphenyl)ethyl]butanamide
CID 81087139
2-bromo-N-[(1S)-1-(2-methylphenyl)ethyl]acetamide
CID 81374930
N-[1-(2-methylphenyl)ethyl]-3-oxobutanamide
CID 18071549
2-(3-aminophenyl)-N-[(1R)-1-(2-methylphenyl)ethyl]acetamide
CID 81380692
2-(2-amino-1,3-thiazol-4-yl)-N-[1-(2-methylphenyl)ethyl]acetamide
CID 62798043
2-(5-amino-2-pyridinyl)-N-[1-(2-methylphenyl)ethyl]acetamide
CID 107338393
2-[2-(aminomethyl)phenyl]-N-[1-(4-chlorophenyl)ethyl]acetamide
CID 81313304
2-[2-(aminomethyl)phenyl]-N-(1-thiophen-2-ylethyl)acetamide
CID 81317529
2-[[2-[2-(aminomethyl)phenyl]acetyl]amino]propanamide
CID 81318090

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide?
The IUPAC name of 2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide (CID 81312311) is 2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide?
The canonical SMILES for 2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide is Cc1ccccc1C(C)NC(=O)Cc1ccccc1CN.
What is the InChIKey of 2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide?
The InChIKey is OADILYJWSUAQMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-13-7-3-6-10-17(13)14(2)20-18(21)11-15-8-4-5-9-16(15)12-19/h3-10,14H,11-12,19H2,1-2H3,(H,20,21).
What are the key properties of 2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide?
2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide has a molecular weight of 282.39 g/mol, XLogP of 2.87, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)phenyl]-N-[1-(2-methylphenyl)ethyl]acetamide is sourced from PubChem (CID 81312311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).