2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide

C13H18N2O2 — CID 104860036

IUPAC2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide
SMILESCC1CC(Nc2ccc(OCC(N)=O)cc2)C1
InChIInChI=1S/C13H18N2O2/c1-9-6-11(7-9)15-10-2-4-12(5-3-10)17-8-13(14)16/h2-5,9,11,15H,6-8H2,1H3,(H2,14,16)
InChIKeyUEUHYYRLUYYRHU-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.76
Rot. Bonds5

About 2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide

2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide (PubChem CID 104860036) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide
PubChem CID104860036
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide
SMILESCC1CC(Nc2ccc(OCC(N)=O)cc2)C1
InChIInChI=1S/C13H18N2O2/c1-9-6-11(7-9)15-10-2-4-12(5-3-10)17-8-13(14)16/h2-5,9,11,15H,6-8H2,1H3,(H2,14,16)
InChIKeyUEUHYYRLUYYRHU-UHFFFAOYSA-N
XLogP1.76
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

2-[4-[(3-propan-2-ylcyclobutyl)amino]phenoxy]acetamide
CID 103561296
2-[4-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]phenoxy]acetamide
CID 43711137
2-[4-[(3-aminocyclopentyl)amino]phenoxy]acetamide
CID 79461446
2-[4-[(4-propan-2-ylcyclohexyl)amino]phenoxy]acetamide
CID 62708775
2-[4-(2,3-dihydro-1H-inden-2-ylamino)phenoxy]acetamide
CID 43711232
2-[4-(thian-4-ylamino)phenoxy]acetamide
CID 43711231
4-ethoxy-N-(3-methylcyclobutyl)aniline
CID 104859963
N-[4-(2-amino-2-oxoethoxy)phenyl]-4-methylpiperidine-2-carboxamide
CID 114423054
4-[2-(dimethylamino)ethoxy]-N-(3-methylcyclobutyl)aniline
CID 104860156
2-[4-(2-bicyclo[2.2.1]heptanylamino)phenoxy]acetamide
CID 61308415
2-[4-(propan-2-ylamino)phenoxy]acetamide
CID 43711183
2-[3-[(5-methylthiolan-3-yl)amino]phenoxy]acetamide
CID 79941354

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide?
The IUPAC name of 2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide (CID 104860036) is 2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide.
What is the SMILES notation for 2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide?
The canonical SMILES for 2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide is CC1CC(Nc2ccc(OCC(N)=O)cc2)C1.
What is the InChIKey of 2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide?
The InChIKey is UEUHYYRLUYYRHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-9-6-11(7-9)15-10-2-4-12(5-3-10)17-8-13(14)16/h2-5,9,11,15H,6-8H2,1H3,(H2,14,16).
What are the key properties of 2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide?
2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide has a molecular weight of 234.30 g/mol, XLogP of 1.76, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(3-methylcyclobutyl)amino]phenoxy]acetamide is sourced from PubChem (CID 104860036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).