2-amino-6-methoxy-N-(1-phenylpropyl)benzamide

C17H20N2O2 — CID 81394668

IUPAC2-amino-6-methoxy-N-(1-phenylpropyl)benzamide
SMILESCCC(NC(=O)c1c(N)cccc1OC)c1ccccc1
InChIInChI=1S/C17H20N2O2/c1-3-14(12-8-5-4-6-9-12)19-17(20)16-13(18)10-7-11-15(16)21-2/h4-11,14H,3,18H2,1-2H3,(H,19,20)
InChIKeyOXWJTWGJXZCXFR-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.16
Rot. Bonds5

About 2-amino-6-methoxy-N-(1-phenylpropyl)benzamide

2-amino-6-methoxy-N-(1-phenylpropyl)benzamide (PubChem CID 81394668) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-amino-6-methoxy-N-(1-phenylpropyl)benzamide.

Molecular Properties

Compound Name2-amino-6-methoxy-N-(1-phenylpropyl)benzamide
PubChem CID81394668
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-amino-6-methoxy-N-(1-phenylpropyl)benzamide
SMILESCCC(NC(=O)c1c(N)cccc1OC)c1ccccc1
InChIInChI=1S/C17H20N2O2/c1-3-14(12-8-5-4-6-9-12)19-17(20)16-13(18)10-7-11-15(16)21-2/h4-11,14H,3,18H2,1-2H3,(H,19,20)
InChIKeyOXWJTWGJXZCXFR-UHFFFAOYSA-N
XLogP3.16
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 ≤ 53.16
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

2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide
CID 94011780
2-amino-6-methoxy-N-pentan-2-ylbenzamide
CID 81409671
2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide
CID 56728765
4,5-dimethoxy-2-methyl-N-(1-phenylpropyl)benzamide
CID 56728755
N-(2-amino-1-phenylethyl)-2-fluoro-6-methoxybenzamide
CID 65432150
3-amino-2,6-difluoro-N-(1-phenylpropyl)benzamide
CID 79760394
3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide
CID 92675789
2-amino-N-(2-hydroxy-1-phenylethyl)-6-methylbenzamide
CID 63184679
2-amino-6-methoxy-N-octan-4-ylbenzamide
CID 106021762
2-amino-N-(5-hydroxypentan-2-yl)-6-methoxybenzamide
CID 81420758
1-N,4-N-bis(1-phenylpropyl)benzene-1,4-dicarboxamide
CID 43912072
2-amino-6-methoxy-N-[1-(methylamino)-1-oxopropan-2-yl]benzamide
CID 81420995

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-methoxy-N-(1-phenylpropyl)benzamide?
The IUPAC name of 2-amino-6-methoxy-N-(1-phenylpropyl)benzamide (CID 81394668) is 2-amino-6-methoxy-N-(1-phenylpropyl)benzamide.
What is the SMILES notation for 2-amino-6-methoxy-N-(1-phenylpropyl)benzamide?
The canonical SMILES for 2-amino-6-methoxy-N-(1-phenylpropyl)benzamide is CCC(NC(=O)c1c(N)cccc1OC)c1ccccc1.
What is the InChIKey of 2-amino-6-methoxy-N-(1-phenylpropyl)benzamide?
The InChIKey is OXWJTWGJXZCXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-3-14(12-8-5-4-6-9-12)19-17(20)16-13(18)10-7-11-15(16)21-2/h4-11,14H,3,18H2,1-2H3,(H,19,20).
What are the key properties of 2-amino-6-methoxy-N-(1-phenylpropyl)benzamide?
2-amino-6-methoxy-N-(1-phenylpropyl)benzamide has a molecular weight of 284.36 g/mol, XLogP of 3.16, 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-(1-phenylpropyl)benzamide is sourced from PubChem (CID 81394668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).