2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide

C15H24N2O3 — CID 81082492

IUPAC2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide
SMILESCCOc1ccc(NC(=O)C(N)CCCOC)c(C)c1
InChIInChI=1S/C15H24N2O3/c1-4-20-12-7-8-14(11(2)10-12)17-15(18)13(16)6-5-9-19-3/h7-8,10,13H,4-6,9,16H2,1-3H3,(H,17,18)
InChIKeyHVMMFKPCXUAJEN-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.09
Rot. Bonds8

About 2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide

2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide (PubChem CID 81082492) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide.

Molecular Properties

Compound Name2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide
PubChem CID81082492
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide
SMILESCCOc1ccc(NC(=O)C(N)CCCOC)c(C)c1
InChIInChI=1S/C15H24N2O3/c1-4-20-12-7-8-14(11(2)10-12)17-15(18)13(16)6-5-9-19-3/h7-8,10,13H,4-6,9,16H2,1-3H3,(H,17,18)
InChIKeyHVMMFKPCXUAJEN-UHFFFAOYSA-N
XLogP2.09
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-5-methoxy-N-(2-methyl-4-propan-2-yloxyphenyl)pentanamide
CID 81071157
2-amino-N-(4-methoxy-2-methylphenyl)hexanamide
CID 62871713
2-amino-N-(4-ethoxy-2-methylphenyl)propanamide;hydrochloride
CID 119298449
N-(4-ethoxy-2-methylphenyl)-2-methoxypropanamide
CID 47312187
2-amino-N-(5-chloro-2-ethoxyphenyl)-5-methoxypentanamide
CID 81083183
2-bromo-N-(4-ethoxy-2-methylphenyl)propanamide
CID 107904117
2-chloro-N-(4-ethoxy-2-methylphenyl)propanamide
CID 60933889
2-amino-N-[1-(4-ethoxyphenyl)ethyl]-5-methoxypentanamide
CID 81070435
4-amino-N-[4-(2-methoxyethoxy)-2-methylphenyl]pentanamide;hydrochloride
CID 120560339
2-amino-N-(2-chloro-5-methoxyphenyl)-5-methoxypentanamide
CID 81089395
2-amino-N-(4-ethoxyphenyl)-4-methoxybutanamide
CID 55080527
2-amino-N-(2,5-dichloro-4-methylphenyl)-5-methoxypentanamide
CID 104727023

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide?
The IUPAC name of 2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide (CID 81082492) is 2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide.
What is the SMILES notation for 2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide?
The canonical SMILES for 2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide is CCOc1ccc(NC(=O)C(N)CCCOC)c(C)c1.
What is the InChIKey of 2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide?
The InChIKey is HVMMFKPCXUAJEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-4-20-12-7-8-14(11(2)10-12)17-15(18)13(16)6-5-9-19-3/h7-8,10,13H,4-6,9,16H2,1-3H3,(H,17,18).
What are the key properties of 2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide?
2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide has a molecular weight of 280.37 g/mol, XLogP of 2.09, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide is sourced from PubChem (CID 81082492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).