2-(5-methoxy-2-methylanilino)butanamide

C12H18N2O2 — CID 167770796

IUPAC2-(5-methoxy-2-methylanilino)butanamide
SMILESCCC(Nc1cc(OC)ccc1C)C(N)=O
InChIInChI=1S/C12H18N2O2/c1-4-10(12(13)15)14-11-7-9(16-3)6-5-8(11)2/h5-7,10,14H,4H2,1-3H3,(H2,13,15)
InChIKeyPHUPDRYAFMJXAH-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.68
Rot. Bonds5

About 2-(5-methoxy-2-methylanilino)butanamide

2-(5-methoxy-2-methylanilino)butanamide (PubChem CID 167770796) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-(5-methoxy-2-methylanilino)butanamide.

Molecular Properties

Compound Name2-(5-methoxy-2-methylanilino)butanamide
PubChem CID167770796
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-(5-methoxy-2-methylanilino)butanamide
SMILESCCC(Nc1cc(OC)ccc1C)C(N)=O
InChIInChI=1S/C12H18N2O2/c1-4-10(12(13)15)14-11-7-9(16-3)6-5-8(11)2/h5-7,10,14H,4H2,1-3H3,(H2,13,15)
InChIKeyPHUPDRYAFMJXAH-UHFFFAOYSA-N
XLogP1.68
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(5-methoxy-2-methylanilino)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-methoxyanilino)butanamide
CID 61005469
4-amino-3-(5-methoxy-2-methylanilino)butanamide
CID 114252672
ethyl 2-(4-methoxy-2-methylanilino)pentanoate
CID 78964712
2-(4-chloro-2-methoxy-5-methylanilino)butanamide
CID 55133159
2-(4-fluoro-2-methoxyanilino)butanamide
CID 62900802
3-(ethylamino)-N-(5-methoxy-2-methylphenyl)-2-methylpropanamide
CID 114252727
2-(5-methoxy-2-methylanilino)-N-propylacetamide
CID 113256459
N-carbamoyl-2-(5-methoxy-2-methylanilino)acetamide
CID 113256460
2-(2-bromo-5-methoxyanilino)-N'-hydroxybutanimidamide
CID 77069907
2-(5-methoxy-2-methylanilino)acetic acid
CID 130496332
3-bromo-N-(5-methoxy-2-methylphenyl)propanamide
CID 130496323
2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide
CID 114252735

Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxy-2-methylanilino)butanamide?
The IUPAC name of 2-(5-methoxy-2-methylanilino)butanamide (CID 167770796) is 2-(5-methoxy-2-methylanilino)butanamide.
What is the SMILES notation for 2-(5-methoxy-2-methylanilino)butanamide?
The canonical SMILES for 2-(5-methoxy-2-methylanilino)butanamide is CCC(Nc1cc(OC)ccc1C)C(N)=O.
What is the InChIKey of 2-(5-methoxy-2-methylanilino)butanamide?
The InChIKey is PHUPDRYAFMJXAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-4-10(12(13)15)14-11-7-9(16-3)6-5-8(11)2/h5-7,10,14H,4H2,1-3H3,(H2,13,15).
What are the key properties of 2-(5-methoxy-2-methylanilino)butanamide?
2-(5-methoxy-2-methylanilino)butanamide has a molecular weight of 222.29 g/mol, XLogP of 1.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxy-2-methylanilino)butanamide is sourced from PubChem (CID 167770796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).