2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide

C15H24N2O2 — CID 55145298

IUPAC2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide
SMILESCNC(CCOc1cc(C(C)C)ccc1C)C(N)=O
InChIInChI=1S/C15H24N2O2/c1-10(2)12-6-5-11(3)14(9-12)19-8-7-13(17-4)15(16)18/h5-6,9-10,13,17H,7-8H2,1-4H3,(H2,16,18)
InChIKeyJBAGMGWZVTXJDL-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.96
Rot. Bonds7

About 2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide

2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide (PubChem CID 55145298) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide.

Molecular Properties

Compound Name2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide
PubChem CID55145298
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide
SMILESCNC(CCOc1cc(C(C)C)ccc1C)C(N)=O
InChIInChI=1S/C15H24N2O2/c1-10(2)12-6-5-11(3)14(9-12)19-8-7-13(17-4)15(16)18/h5-6,9-10,13,17H,7-8H2,1-4H3,(H2,16,18)
InChIKeyJBAGMGWZVTXJDL-UHFFFAOYSA-N
XLogP1.96
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-fluoro-2-methylphenoxy)-2-(methylamino)butanamide
CID 102983847
2-(methylamino)-4-(2,3,5-trimethylphenoxy)butanamide
CID 55143007
N-methyl-2-(2-methyl-5-propan-2-ylphenoxy)ethanamine
CID 61035897
4-(3-fluoro-4-methylphenoxy)-2-(methylamino)butanamide
CID 107170389
N-methyl-3-(2-methyl-5-propan-2-ylphenoxy)propan-1-amine
CID 61036143
2-(2-methoxyethoxy)-1-methyl-4-propan-2-ylbenzene
CID 112722468
2-(ethylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butan-1-ol
CID 64810580
1-methyl-4-propan-2-yl-2-propoxybenzene
CID 78907679
N-butan-2-yl-4-(2-methyl-5-propan-2-ylphenoxy)butan-1-amine;oxalic acid
CID 2934388
2-(methylamino)-4-(4-propan-2-ylphenoxy)butanoic acid
CID 63038968
2-(methylamino)-4-(4-methyl-2-nitrophenoxy)butanamide
CID 55144333
2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide
CID 78906214

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide?
The IUPAC name of 2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide (CID 55145298) is 2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide.
What is the SMILES notation for 2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide?
The canonical SMILES for 2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide is CNC(CCOc1cc(C(C)C)ccc1C)C(N)=O.
What is the InChIKey of 2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide?
The InChIKey is JBAGMGWZVTXJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-10(2)12-6-5-11(3)14(9-12)19-8-7-13(17-4)15(16)18/h5-6,9-10,13,17H,7-8H2,1-4H3,(H2,16,18).
What are the key properties of 2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide?
2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide has a molecular weight of 264.37 g/mol, XLogP of 1.96, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-4-(2-methyl-5-propan-2-ylphenoxy)butanamide is sourced from PubChem (CID 55145298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).