2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide

C19H24N2O2 — CID 120667763

IUPAC2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide
SMILESCCCCOc1cccc(NC(=O)C(N)c2ccc(C)cc2)c1
InChIInChI=1S/C19H24N2O2/c1-3-4-12-23-17-7-5-6-16(13-17)21-19(22)18(20)15-10-8-14(2)9-11-15/h5-11,13,18H,3-4,12,20H2,1-2H3,(H,21,22)
InChIKeyLQXDBDGQZQJFOE-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.81
Rot. Bonds7

About 2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide

2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide (PubChem CID 120667763) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide
PubChem CID120667763
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide
SMILESCCCCOc1cccc(NC(=O)C(N)c2ccc(C)cc2)c1
InChIInChI=1S/C19H24N2O2/c1-3-4-12-23-17-7-5-6-16(13-17)21-19(22)18(20)15-10-8-14(2)9-11-15/h5-11,13,18H,3-4,12,20H2,1-2H3,(H,21,22)
InChIKeyLQXDBDGQZQJFOE-UHFFFAOYSA-N
XLogP3.81
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-[3-(3-methoxypropoxy)phenyl]-2-(4-methylphenyl)acetamide
CID 120669115
2-amino-2-(4-methylphenyl)-N-[3-(2-methylpropoxy)phenyl]acetamide;hydrochloride
CID 120667184
N-(3-hexoxyphenyl)-2-(4-methylphenoxy)propanamide
CID 17094785
2-amino-N-(3-cyclopentyloxyphenyl)-2-(4-methylphenyl)acetamide
CID 120667187
N-(3-heptoxyphenyl)-4-methylbenzamide
CID 17138098
3-amino-2-methyl-3-phenyl-N-(3-propoxyphenyl)propanamide
CID 119715007
2-amino-N-[3-(3-cyanopropoxy)phenyl]hexanamide
CID 60927656
(2S)-2-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]hexanamide
CID 103831964
3-amino-4-oxo-4-(3-propoxyanilino)butanoic acid
CID 64894519
(3-hexoxyphenyl)urea
CID 102387253
2-amino-5-methoxy-N-(3-propoxyphenyl)pentanamide
CID 81082999
butyl 2-(3-acetamidophenoxy)acetate
CID 54941709

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide?
The IUPAC name of 2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide (CID 120667763) is 2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide?
The canonical SMILES for 2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide is CCCCOc1cccc(NC(=O)C(N)c2ccc(C)cc2)c1.
What is the InChIKey of 2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide?
The InChIKey is LQXDBDGQZQJFOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-3-4-12-23-17-7-5-6-16(13-17)21-19(22)18(20)15-10-8-14(2)9-11-15/h5-11,13,18H,3-4,12,20H2,1-2H3,(H,21,22).
What are the key properties of 2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide?
2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide has a molecular weight of 312.41 g/mol, XLogP of 3.81, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-butoxyphenyl)-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 120667763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).