5-amino-2-(2-methoxypropoxy)benzamide

C11H16N2O3 — CID 106956252

IUPAC5-amino-2-(2-methoxypropoxy)benzamide
SMILESCOC(C)COc1ccc(N)cc1C(N)=O
InChIInChI=1S/C11H16N2O3/c1-7(15-2)6-16-10-4-3-8(12)5-9(10)11(13)14/h3-5,7H,6,12H2,1-2H3,(H2,13,14)
InChIKeyMHTDLQWIAJLSBK-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.78
Rot. Bonds5

About 5-amino-2-(2-methoxypropoxy)benzamide

5-amino-2-(2-methoxypropoxy)benzamide (PubChem CID 106956252) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 5-amino-2-(2-methoxypropoxy)benzamide.

Molecular Properties

Compound Name5-amino-2-(2-methoxypropoxy)benzamide
PubChem CID106956252
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name5-amino-2-(2-methoxypropoxy)benzamide
SMILESCOC(C)COc1ccc(N)cc1C(N)=O
InChIInChI=1S/C11H16N2O3/c1-7(15-2)6-16-10-4-3-8(12)5-9(10)11(13)14/h3-5,7H,6,12H2,1-2H3,(H2,13,14)
InChIKeyMHTDLQWIAJLSBK-UHFFFAOYSA-N
XLogP0.78
TPSA87.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-amino-2-(2-methylpentoxy)benzamide
CID 103284499
methyl 5-amino-2-(2-methylpropoxy)benzoate
CID 61307222
5-amino-2-butoxybenzamide
CID 61305277
4-amino-2-(2-hydroxypropoxy)benzamide
CID 106955593
5-amino-2-(3-amino-3-oxopropoxy)benzamide
CID 106956094
4-(2-methylpropoxy)benzene-1,3-dicarboxamide
CID 162371646
5-amino-2-(2,2,2-trifluoroethoxy)benzamide
CID 61312859
5-amino-2-(3-methylsulfonylpropoxy)benzamide
CID 106956095
5-amino-2-(2,2,3,3-tetrafluoropropoxy)benzamide
CID 55136526
5-amino-2-[2-oxo-2-(pentan-3-ylamino)ethoxy]benzamide
CID 106956198
2,5-bis(2-methoxypropoxy)benzene-1,4-dicarbohydrazide
CID 176549581
5-amino-N,N-diethyl-2-(2-methylpropoxy)benzamide
CID 134821733

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(2-methoxypropoxy)benzamide?
The IUPAC name of 5-amino-2-(2-methoxypropoxy)benzamide (CID 106956252) is 5-amino-2-(2-methoxypropoxy)benzamide.
What is the SMILES notation for 5-amino-2-(2-methoxypropoxy)benzamide?
The canonical SMILES for 5-amino-2-(2-methoxypropoxy)benzamide is COC(C)COc1ccc(N)cc1C(N)=O.
What is the InChIKey of 5-amino-2-(2-methoxypropoxy)benzamide?
The InChIKey is MHTDLQWIAJLSBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-7(15-2)6-16-10-4-3-8(12)5-9(10)11(13)14/h3-5,7H,6,12H2,1-2H3,(H2,13,14).
What are the key properties of 5-amino-2-(2-methoxypropoxy)benzamide?
5-amino-2-(2-methoxypropoxy)benzamide has a molecular weight of 224.26 g/mol, XLogP of 0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(2-methoxypropoxy)benzamide is sourced from PubChem (CID 106956252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).