4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide

C15H24N2O2 — CID 115155476

IUPAC4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide
SMILESCOc1ccc(C)cc1CCN(C)C(=O)CCCN
InChIInChI=1S/C15H24N2O2/c1-12-6-7-14(19-3)13(11-12)8-10-17(2)15(18)5-4-9-16/h6-7,11H,4-5,8-10,16H2,1-3H3
InChIKeyYZDAMCJUTLHVKB-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.74
Rot. Bonds7

About 4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide

4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide (PubChem CID 115155476) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide.

Molecular Properties

Compound Name4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide
PubChem CID115155476
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide
SMILESCOc1ccc(C)cc1CCN(C)C(=O)CCCN
InChIInChI=1S/C15H24N2O2/c1-12-6-7-14(19-3)13(11-12)8-10-17(2)15(18)5-4-9-16/h6-7,11H,4-5,8-10,16H2,1-3H3
InChIKeyYZDAMCJUTLHVKB-UHFFFAOYSA-N
XLogP1.74
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-[2-(5-bromo-2-methoxyphenyl)ethyl]-N-methylbutanamide
CID 115155486
3-hydroxy-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylpropanamide
CID 115139401
3-amino-N-[2-(5-ethyl-2-methoxyphenyl)ethyl]-N-methylpropanamide
CID 94694459
2-(ethylamino)-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylacetamide
CID 115158094
N'-[2-(2-methoxy-5-methylphenyl)ethyl]-N'-methylmethanediamine
CID 115226171
4-amino-N-[(5-ethyl-2-methoxyphenyl)methyl]-N-methylbutanamide
CID 115155352
6-amino-1-(2-methoxy-5-methylphenyl)hexan-2-one
CID 116572089
4-amino-N-[(4-methoxy-3-methylphenyl)methyl]-N-methylbutanamide
CID 115155334
N-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-hydroxy-N-methylpropanamide
CID 115139416
5-amino-N-[(2-methoxy-5-methylphenyl)methyl]-N,4-dimethylpentanamide
CID 82011236
N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylazetidine-3-carboxamide
CID 115159073
N'-ethyl-N'-[(2-methoxy-5-methylphenyl)methyl]propane-1,3-diamine
CID 62155475

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide?
The IUPAC name of 4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide (CID 115155476) is 4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide.
What is the SMILES notation for 4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide?
The canonical SMILES for 4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide is COc1ccc(C)cc1CCN(C)C(=O)CCCN.
What is the InChIKey of 4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide?
The InChIKey is YZDAMCJUTLHVKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-12-6-7-14(19-3)13(11-12)8-10-17(2)15(18)5-4-9-16/h6-7,11H,4-5,8-10,16H2,1-3H3.
What are the key properties of 4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide?
4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide has a molecular weight of 264.37 g/mol, XLogP of 1.74, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(2-methoxy-5-methylphenyl)ethyl]-N-methylbutanamide is sourced from PubChem (CID 115155476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).