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

C14H19FN2O2 — CID 103161664

IUPACN-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide
SMILESCCOC1CC(CC(=O)Nc2ccc(N)c(F)c2)C1
InChIInChI=1S/C14H19FN2O2/c1-2-19-11-5-9(6-11)7-14(18)17-10-3-4-13(16)12(15)8-10/h3-4,8-9,11H,2,5-7,16H2,1H3,(H,17,18)
InChIKeyQWMSHXFLRRGJGD-UHFFFAOYSA-N
MW266.32 g/mol
LogP2.55
Rot. Bonds5

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

N-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide (PubChem CID 103161664) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is N-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide.

Molecular Properties

Compound NameN-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide
PubChem CID103161664
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC NameN-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide
SMILESCCOC1CC(CC(=O)Nc2ccc(N)c(F)c2)C1
InChIInChI=1S/C14H19FN2O2/c1-2-19-11-5-9(6-11)7-14(18)17-10-3-4-13(16)12(15)8-10/h3-4,8-9,11H,2,5-7,16H2,1H3,(H,17,18)
InChIKeyQWMSHXFLRRGJGD-UHFFFAOYSA-N
XLogP2.55
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 52.55
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-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103161581
N-(3-cyano-4-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103163570
N-(2-amino-4-hydroxyphenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 107697268
2-(3-ethoxycyclobutyl)-N-(4-sulfamoylphenyl)acetamide
CID 103164408
2-bromo-5-[[2-(3-ethoxycyclobutyl)acetyl]amino]benzoic acid
CID 103162104
2-[4-[[2-(3-ethoxycyclobutyl)acetyl]amino]phenyl]acetic acid
CID 103161737
2-(3-ethoxycyclobutyl)-N-[4-[(Z)-N'-hydroxycarbamimidoyl]phenyl]acetamide
CID 103166077
N-(2-bromo-5-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103270141
4-[[(3-ethoxycyclobutyl)amino]methyl]-2-fluoroaniline
CID 114119839
3-bromo-5-[[2-(3-ethoxycyclobutyl)acetyl]amino]benzoic acid
CID 103162083
2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid
CID 107338759
N-(3-amino-4-fluorophenyl)-2-cyclobutylacetamide
CID 103805248

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide?
The IUPAC name of N-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide (CID 103161664) is N-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide.
What is the SMILES notation for N-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide?
The canonical SMILES for N-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide is CCOC1CC(CC(=O)Nc2ccc(N)c(F)c2)C1.
What is the InChIKey of N-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide?
The InChIKey is QWMSHXFLRRGJGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-2-19-11-5-9(6-11)7-14(18)17-10-3-4-13(16)12(15)8-10/h3-4,8-9,11H,2,5-7,16H2,1H3,(H,17,18).
What are the key properties of N-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide?
N-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide has a molecular weight of 266.32 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-3-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide is sourced from PubChem (CID 103161664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).