2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide

C17H20N2O2 — CID 61112703

IUPAC2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide
SMILESCOc1ccc(N)c(C(=O)N(C)C(C)c2ccccc2)c1
InChIInChI=1S/C17H20N2O2/c1-12(13-7-5-4-6-8-13)19(2)17(20)15-11-14(21-3)9-10-16(15)18/h4-12H,18H2,1-3H3
InChIKeyWHGLARUGZKFONX-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.11
Rot. Bonds4

About 2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide

2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide (PubChem CID 61112703) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide.

Molecular Properties

Compound Name2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide
PubChem CID61112703
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide
SMILESCOc1ccc(N)c(C(=O)N(C)C(C)c2ccccc2)c1
InChIInChI=1S/C17H20N2O2/c1-12(13-7-5-4-6-8-13)19(2)17(20)15-11-14(21-3)9-10-16(15)18/h4-12H,18H2,1-3H3
InChIKeyWHGLARUGZKFONX-UHFFFAOYSA-N
XLogP3.11
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2,5-dimethoxy-N-methyl-N-(1-phenylethyl)benzamide
CID 43022056
4-amino-N,3-dimethyl-N-(1-phenylethyl)benzamide
CID 60939381
2-bromo-N-[1-(4-fluorophenyl)ethyl]-5-methoxy-N-methylbenzamide
CID 18102328
2-amino-5-methoxy-N-methyl-N-(2-phenylethyl)benzamide
CID 61110256
2-amino-5-methoxybenzoic acid;hydrochloride
CID 15618229
2-amino-4-methoxy-N-methyl-N-(3-methylbutan-2-yl)benzamide
CID 113305134
2,5-dimethoxy-N-[1-(2-methoxyphenyl)ethyl]-N-methylbenzamide
CID 74627130
5-amino-2-fluoro-N-methyl-N-(1-phenylethyl)benzamide
CID 61111567
5-amino-N-[1-(4-methoxyphenyl)ethyl]-N,2-dimethylbenzamide;hydrochloride
CID 120620042
N,2-dimethyl-N-(1-phenylethyl)benzamide
CID 78799210
5-fluoro-2-methoxy-N-methyl-N-[(1S)-1-phenylethyl]benzamide
CID 166382855
2-amino-5-methoxy-N-propan-2-yl-N-propylbenzamide
CID 54878406

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide?
The IUPAC name of 2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide (CID 61112703) is 2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide.
What is the SMILES notation for 2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide?
The canonical SMILES for 2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide is COc1ccc(N)c(C(=O)N(C)C(C)c2ccccc2)c1.
What is the InChIKey of 2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide?
The InChIKey is WHGLARUGZKFONX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12(13-7-5-4-6-8-13)19(2)17(20)15-11-14(21-3)9-10-16(15)18/h4-12H,18H2,1-3H3.
What are the key properties of 2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide?
2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide has a molecular weight of 284.36 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methoxy-N-methyl-N-(1-phenylethyl)benzamide is sourced from PubChem (CID 61112703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).