2-[4-(2-methoxyphenoxy)anilino]butanamide

C17H20N2O3 — CID 56788783

IUPAC2-[4-(2-methoxyphenoxy)anilino]butanamide
SMILESCCC(Nc1ccc(Oc2ccccc2OC)cc1)C(N)=O
InChIInChI=1S/C17H20N2O3/c1-3-14(17(18)20)19-12-8-10-13(11-9-12)22-16-7-5-4-6-15(16)21-2/h4-11,14,19H,3H2,1-2H3,(H2,18,20)
InChIKeyZSXHXPXZSWCXJR-UHFFFAOYSA-N
MW300.36 g/mol
LogP3.16
Rot. Bonds7

About 2-[4-(2-methoxyphenoxy)anilino]butanamide

2-[4-(2-methoxyphenoxy)anilino]butanamide (PubChem CID 56788783) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-[4-(2-methoxyphenoxy)anilino]butanamide.

Molecular Properties

Compound Name2-[4-(2-methoxyphenoxy)anilino]butanamide
PubChem CID56788783
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name2-[4-(2-methoxyphenoxy)anilino]butanamide
SMILESCCC(Nc1ccc(Oc2ccccc2OC)cc1)C(N)=O
InChIInChI=1S/C17H20N2O3/c1-3-14(17(18)20)19-12-8-10-13(11-9-12)22-16-7-5-4-6-15(16)21-2/h4-11,14,19H,3H2,1-2H3,(H2,18,20)
InChIKeyZSXHXPXZSWCXJR-UHFFFAOYSA-N
XLogP3.16
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methoxyphenoxy)anilino]butanamide?
The IUPAC name of 2-[4-(2-methoxyphenoxy)anilino]butanamide (CID 56788783) is 2-[4-(2-methoxyphenoxy)anilino]butanamide.
What is the SMILES notation for 2-[4-(2-methoxyphenoxy)anilino]butanamide?
The canonical SMILES for 2-[4-(2-methoxyphenoxy)anilino]butanamide is CCC(Nc1ccc(Oc2ccccc2OC)cc1)C(N)=O.
What is the InChIKey of 2-[4-(2-methoxyphenoxy)anilino]butanamide?
The InChIKey is ZSXHXPXZSWCXJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-3-14(17(18)20)19-12-8-10-13(11-9-12)22-16-7-5-4-6-15(16)21-2/h4-11,14,19H,3H2,1-2H3,(H2,18,20).
What are the key properties of 2-[4-(2-methoxyphenoxy)anilino]butanamide?
2-[4-(2-methoxyphenoxy)anilino]butanamide has a molecular weight of 300.36 g/mol, XLogP of 3.16, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methoxyphenoxy)anilino]butanamide is sourced from PubChem (CID 56788783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).