N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide

C14H20N2O2 — CID 113429848

IUPACN-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide
SMILESCOC1CC(NCc2ccccc2NC(C)=O)C1
InChIInChI=1S/C14H20N2O2/c1-10(17)16-14-6-4-3-5-11(14)9-15-12-7-13(8-12)18-2/h3-6,12-13,15H,7-9H2,1-2H3,(H,16,17)
InChIKeyVZHPEQBNDIQSBD-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.91
Rot. Bonds5

About N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide

N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide (PubChem CID 113429848) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide
PubChem CID113429848
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide
SMILESCOC1CC(NCc2ccccc2NC(C)=O)C1
InChIInChI=1S/C14H20N2O2/c1-10(17)16-14-6-4-3-5-11(14)9-15-12-7-13(8-12)18-2/h3-6,12-13,15H,7-9H2,1-2H3,(H,16,17)
InChIKeyVZHPEQBNDIQSBD-UHFFFAOYSA-N
XLogP1.91
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-[(cyclohexylamino)methyl]phenyl]acetamide
CID 66289861
N-[2-[[(5-oxopyrrolidin-3-yl)amino]methyl]phenyl]acetamide
CID 114155218
2-bromo-6-[[(3-methoxycyclobutyl)amino]methyl]phenol
CID 104588033
N-[2-[[(2,2-dimethyloxan-4-yl)amino]methyl]phenyl]acetamide
CID 115563696
N-[[2-(diethylaminomethyl)phenyl]methyl]-3-methoxycyclobutan-1-amine
CID 104870820
methyl 2-[[(3-methoxycyclopentyl)amino]methyl]benzoate
CID 103083146
N-[2-[[(2,4-dimethylcyclohexyl)amino]methyl]phenyl]acetamide
CID 66418273
N-[2-[[(1-ethylpiperidin-3-yl)amino]methyl]phenyl]acetamide
CID 66419821
N-[2-[(2-methylpropoxyamino)methyl]phenyl]acetamide
CID 82710042
N-methyl-2-[[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]methyl]aniline
CID 138052411
N-[2-[[(3-methoxycyclopentyl)amino]methyl]thiophen-3-yl]acetamide
CID 114117948
N-[2-[[(1,1-dioxo-2,3-dihydrothiophen-3-yl)amino]methyl]phenyl]acetamide
CID 66419453

Frequently Asked Questions

What is the IUPAC name of N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide?
The IUPAC name of N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide (CID 113429848) is N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide.
What is the SMILES notation for N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide?
The canonical SMILES for N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide is COC1CC(NCc2ccccc2NC(C)=O)C1.
What is the InChIKey of N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide?
The InChIKey is VZHPEQBNDIQSBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10(17)16-14-6-4-3-5-11(14)9-15-12-7-13(8-12)18-2/h3-6,12-13,15H,7-9H2,1-2H3,(H,16,17).
What are the key properties of N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide?
N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide is sourced from PubChem (CID 113429848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).