N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide

C15H24N2O2 — CID 82260032

IUPACN-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide
SMILESCCOc1cc(CC(N)C(C)C)ccc1NC(C)=O
InChIInChI=1S/C15H24N2O2/c1-5-19-15-9-12(8-13(16)10(2)3)6-7-14(15)17-11(4)18/h6-7,9-10,13H,5,8,16H2,1-4H3,(H,17,18)
InChIKeyFQHONDXZAXDUEH-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.57
Rot. Bonds6

About N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide

N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide (PubChem CID 82260032) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide
PubChem CID82260032
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide
SMILESCCOc1cc(CC(N)C(C)C)ccc1NC(C)=O
InChIInChI=1S/C15H24N2O2/c1-5-19-15-9-12(8-13(16)10(2)3)6-7-14(15)17-11(4)18/h6-7,9-10,13H,5,8,16H2,1-4H3,(H,17,18)
InChIKeyFQHONDXZAXDUEH-UHFFFAOYSA-N
XLogP2.57
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-aminobutyl)-2-ethoxyphenyl]-3-cyclohexylpropanamide
CID 82259817
(2R)-2-amino-N-(2-ethoxy-4-methylphenyl)-3-methylbutanamide
CID 79013044
N-[4-(2-bromo-4-methylpentyl)-2-ethoxyphenyl]-2-methoxyacetamide
CID 82259560
diethyl 2-[(3,4-diethoxyphenyl)methyl]propanedioate
CID 71574869
N-[2-ethoxy-5-(hydroxymethyl)phenyl]acetamide
CID 82470650
2-(3-acetamido-4-ethoxyphenyl)acetamide
CID 96674142
N-[4-(2-bromobutyl)-2-ethoxyphenyl]cyclopropanecarboxamide
CID 82259351
N-[4-(2-bromopentyl)-2-ethoxyphenyl]-2,2-dimethylpropanamide
CID 82259416
2-amino-N-(2-ethoxy-4-fluorophenyl)propanamide;hydrochloride
CID 119286702
N-[2-ethoxy-5-(2-oxopropyl)phenyl]acetamide
CID 96673990
2-amino-3-(4-ethoxy-3-methoxyphenyl)propanoic acid
CID 54846805
3-(4-acetamido-3-ethoxyanilino)-3-oxopropanoic acid
CID 56605115

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide?
The IUPAC name of N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide (CID 82260032) is N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide.
What is the SMILES notation for N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide?
The canonical SMILES for N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide is CCOc1cc(CC(N)C(C)C)ccc1NC(C)=O.
What is the InChIKey of N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide?
The InChIKey is FQHONDXZAXDUEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-19-15-9-12(8-13(16)10(2)3)6-7-14(15)17-11(4)18/h6-7,9-10,13H,5,8,16H2,1-4H3,(H,17,18).
What are the key properties of N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide?
N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide has a molecular weight of 264.37 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-amino-3-methylbutyl)-2-ethoxyphenyl]acetamide is sourced from PubChem (CID 82260032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).