N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide

C16H24N2O2 — CID 103161581

IUPACN-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide
SMILESCCOC1CC(CC(=O)Nc2ccc(CC)c(N)c2)C1
InChIInChI=1S/C16H24N2O2/c1-3-12-5-6-13(10-15(12)17)18-16(19)9-11-7-14(8-11)20-4-2/h5-6,10-11,14H,3-4,7-9,17H2,1-2H3,(H,18,19)
InChIKeyLYJZFQXXAPRBPU-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.97
Rot. Bonds6

About N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide

N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide (PubChem CID 103161581) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide.

Molecular Properties

Compound NameN-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide
PubChem CID103161581
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide
SMILESCCOC1CC(CC(=O)Nc2ccc(CC)c(N)c2)C1
InChIInChI=1S/C16H24N2O2/c1-3-12-5-6-13(10-15(12)17)18-16(19)9-11-7-14(8-11)20-4-2/h5-6,10-11,14H,3-4,7-9,17H2,1-2H3,(H,18,19)
InChIKeyLYJZFQXXAPRBPU-UHFFFAOYSA-N
XLogP2.97
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103161664
N-(3-amino-4-ethylphenyl)-2-cyclohexylacetamide
CID 43550224
2-[4-[[2-(3-ethoxycyclobutyl)acetyl]amino]phenyl]acetic acid
CID 103161737
2-(3-ethoxycyclobutyl)-N-(4-sulfamoylphenyl)acetamide
CID 103164408
2-bromo-5-[[2-(3-ethoxycyclobutyl)acetyl]amino]benzoic acid
CID 103162104
N-(2-amino-4-hydroxyphenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 107697268
2-(3-ethoxycyclobutyl)-N-[4-[(Z)-N'-hydroxycarbamimidoyl]phenyl]acetamide
CID 103166077
N-(3-cyano-4-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103163570
2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid
CID 107338759
3-bromo-5-[[2-(3-ethoxycyclobutyl)acetyl]amino]benzoic acid
CID 103162083
N-(2-bromo-5-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103270141
2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide
CID 103163808

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide?
The IUPAC name of N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide (CID 103161581) is N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide.
What is the SMILES notation for N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide?
The canonical SMILES for N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide is CCOC1CC(CC(=O)Nc2ccc(CC)c(N)c2)C1.
What is the InChIKey of N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide?
The InChIKey is LYJZFQXXAPRBPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-3-12-5-6-13(10-15(12)17)18-16(19)9-11-7-14(8-11)20-4-2/h5-6,10-11,14H,3-4,7-9,17H2,1-2H3,(H,18,19).
What are the key properties of N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide?
N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.97, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide is sourced from PubChem (CID 103161581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).