2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide

C17H20N2O2 — CID 81395621

IUPAC2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide
SMILESCOc1cccc(N)c1C(=O)NCCc1ccccc1C
InChIInChI=1S/C17H20N2O2/c1-12-6-3-4-7-13(12)10-11-19-17(20)16-14(18)8-5-9-15(16)21-2/h3-9H,10-11,18H2,1-2H3,(H,19,20)
InChIKeyBLNQEUWLEMUZBI-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.56
Rot. Bonds5

About 2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide

2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide (PubChem CID 81395621) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide.

Molecular Properties

Compound Name2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide
PubChem CID81395621
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide
SMILESCOc1cccc(N)c1C(=O)NCCc1ccccc1C
InChIInChI=1S/C17H20N2O2/c1-12-6-3-4-7-13(12)10-11-19-17(20)16-14(18)8-5-9-15(16)21-2/h3-9H,10-11,18H2,1-2H3,(H,19,20)
InChIKeyBLNQEUWLEMUZBI-UHFFFAOYSA-N
XLogP2.56
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-6-methoxy-N-[(2-methylphenyl)methyl]benzamide
CID 81421054
2-amino-N-[2-(furan-2-yl)ethyl]-6-methoxybenzamide
CID 81421132
2-amino-N-(3-hydroxypropyl)-6-methoxybenzamide
CID 81421037
2-amino-N-[2-(4-chlorophenyl)ethyl]-6-methoxybenzamide
CID 81395966
2-amino-N-(2-ethyl-6-methylphenyl)-6-methoxybenzamide
CID 81394285
N-[2-(2-methoxyphenyl)ethyl]-2,3-dimethylbenzamide
CID 26778040
2-amino-5-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide
CID 79756137
2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide
CID 112766523
2-amino-N-(3-hydroxybutyl)-6-methoxybenzamide
CID 81420949
2-amino-6-methoxy-N-(2-methylphenyl)benzamide
CID 81410704
2-amino-6-methoxy-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]benzamide
CID 81420398
2-amino-6-methoxy-N-[2-(1-methylpyrazol-4-yl)ethyl]benzamide
CID 81420546

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide?
The IUPAC name of 2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide (CID 81395621) is 2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide.
What is the SMILES notation for 2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide?
The canonical SMILES for 2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide is COc1cccc(N)c1C(=O)NCCc1ccccc1C.
What is the InChIKey of 2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide?
The InChIKey is BLNQEUWLEMUZBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12-6-3-4-7-13(12)10-11-19-17(20)16-14(18)8-5-9-15(16)21-2/h3-9H,10-11,18H2,1-2H3,(H,19,20).
What are the key properties of 2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide?
2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide has a molecular weight of 284.36 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide is sourced from PubChem (CID 81395621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).