2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide

C17H20N2O — CID 63589585

IUPAC2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide
SMILESCCc1cccc(NC(=O)Cc2ccc(CN)cc2)c1
InChIInChI=1S/C17H20N2O/c1-2-13-4-3-5-16(10-13)19-17(20)11-14-6-8-15(12-18)9-7-14/h3-10H,2,11-12,18H2,1H3,(H,19,20)
InChIKeySYZHUXPVYIUQLZ-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.89
Rot. Bonds5

About 2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide

2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide (PubChem CID 63589585) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide
PubChem CID63589585
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide
SMILESCCc1cccc(NC(=O)Cc2ccc(CN)cc2)c1
InChIInChI=1S/C17H20N2O/c1-2-13-4-3-5-16(10-13)19-17(20)11-14-6-8-15(12-18)9-7-14/h3-10H,2,11-12,18H2,1H3,(H,19,20)
InChIKeySYZHUXPVYIUQLZ-UHFFFAOYSA-N
XLogP2.89
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(aminomethyl)phenyl]-N-(3-methylphenyl)acetamide
CID 63590654
N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 23579193
2-(2-aminophenyl)-N-(3-ethylphenyl)acetamide
CID 16785552
3-amino-N-(3-ethylphenyl)-3-sulfanylidenepropanamide
CID 28942511
3-[[2-[4-(aminomethyl)phenyl]acetyl]amino]benzamide
CID 107811064
2-chloro-N-(3-ethylphenyl)acetamide
CID 2384588
N-[3-(aminomethyl)phenyl]-4-ethylbenzamide
CID 18072148
5-(aminomethyl)-N-(3-ethylphenyl)pyridine-2-carboxamide
CID 55230586
1-[3-(aminomethyl)phenyl]-3-[(4-ethylphenyl)methyl]urea
CID 106900402
N-[3-(aminomethyl)phenyl]-2-(diethylamino)acetamide
CID 16779439
2-[3-(aminomethyl)phenyl]-N-phenylacetamide
CID 154574877
N-[3-(aminomethyl)phenyl]-2-methylsulfanylacetamide
CID 63254431

Frequently Asked Questions

What is the IUPAC name of 2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide?
The IUPAC name of 2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide (CID 63589585) is 2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide.
What is the SMILES notation for 2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide?
The canonical SMILES for 2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide is CCc1cccc(NC(=O)Cc2ccc(CN)cc2)c1.
What is the InChIKey of 2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide?
The InChIKey is SYZHUXPVYIUQLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-2-13-4-3-5-16(10-13)19-17(20)11-14-6-8-15(12-18)9-7-14/h3-10H,2,11-12,18H2,1H3,(H,19,20).
What are the key properties of 2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide?
2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide has a molecular weight of 268.36 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide is sourced from PubChem (CID 63589585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).