2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride

C16H19ClN2O2 — CID 119032182

IUPAC2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride
SMILESCOc1ccc(N(Cc2ccccc2)C(=O)CN)cc1.Cl
InChIInChI=1S/C16H18N2O2.ClH/c1-20-15-9-7-14(8-10-15)18(16(19)11-17)12-13-5-3-2-4-6-13;/h2-10H,11-12,17H2,1H3;1H
InChIKeyBCPRRRKNPUEBJR-UHFFFAOYSA-N
MW306.79 g/mol
LogP2.61
Rot. Bonds5

About 2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride

2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride (PubChem CID 119032182) has the molecular formula C16H19ClN2O2 and a molecular weight of 306.79 g/mol. Its IUPAC name is 2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride
PubChem CID119032182
Molecular FormulaC16H19ClN2O2
Molecular Weight306.79 g/mol
Exact Mass306.11
IUPAC Name2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride
SMILESCOc1ccc(N(Cc2ccccc2)C(=O)CN)cc1.Cl
InChIInChI=1S/C16H18N2O2.ClH/c1-20-15-9-7-14(8-10-15)18(16(19)11-17)12-13-5-3-2-4-6-13;/h2-10H,11-12,17H2,1H3;1H
InChIKeyBCPRRRKNPUEBJR-UHFFFAOYSA-N
XLogP2.61
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.79
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 60594646
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2-amino-N-[(4-ethylphenyl)methyl]-N-phenylacetamide
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N-benzyl-4-fluoro-N-(4-methoxyphenyl)benzamide
CID 3724237
N-benzyl-N-[4-[2-(4-methoxyanilino)-2-oxoethyl]phenyl]propanamide
CID 46045773
N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide
CID 119691210
2-amino-N-[(4-chlorophenyl)methyl]-N-phenylacetamide
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N-benzyl-N-(4-methoxyphenyl)-2-thiomorpholin-3-ylacetamide;hydrochloride
CID 119935581
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CID 10573232

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride?
The IUPAC name of 2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride (CID 119032182) is 2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride is COc1ccc(N(Cc2ccccc2)C(=O)CN)cc1.Cl.
What is the InChIKey of 2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride?
The InChIKey is BCPRRRKNPUEBJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2.ClH/c1-20-15-9-7-14(8-10-15)18(16(19)11-17)12-13-5-3-2-4-6-13;/h2-10H,11-12,17H2,1H3;1H.
What are the key properties of 2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride?
2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride has a molecular weight of 306.79 g/mol, XLogP of 2.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride is sourced from PubChem (CID 119032182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).