N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide

C14H20N2O2 — CID 119796176

IUPACN-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide
SMILESCNCC(=O)NCc1ccccc1OC1CCC1
InChIInChI=1S/C14H20N2O2/c1-15-10-14(17)16-9-11-5-2-3-8-13(11)18-12-6-4-7-12/h2-3,5,8,12,15H,4,6-7,9-10H2,1H3,(H,16,17)
InChIKeyROVZHJUGSCOVHD-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.45
Rot. Bonds6

About N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide

N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide (PubChem CID 119796176) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide
PubChem CID119796176
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide
SMILESCNCC(=O)NCc1ccccc1OC1CCC1
InChIInChI=1S/C14H20N2O2/c1-15-10-14(17)16-9-11-5-2-3-8-13(11)18-12-6-4-7-12/h2-3,5,8,12,15H,4,6-7,9-10H2,1H3,(H,16,17)
InChIKeyROVZHJUGSCOVHD-UHFFFAOYSA-N
XLogP1.45
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[(2-cyclopentyloxyphenyl)methyl]acetamide
CID 119284470
3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide
CID 119284468
N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide
CID 119714426
(2R)-2-amino-N-[(2-cyclobutyloxyphenyl)methyl]propanamide
CID 119330644
(2S)-2-amino-N-[(2-cyclobutyloxyphenyl)methyl]-3,3-dimethylbutanamide;hydrochloride
CID 119796181
2-amino-N-[(2-cyclobutyloxyphenyl)methyl]pentanamide
CID 119330646
2-amino-N-[(2-cyclopentyloxyphenyl)methyl]-2-phenylpropanamide;hydrochloride
CID 120588362
N-[(2-cyclopentyloxyphenyl)methyl]-2,3-dimethoxybenzamide
CID 55810457
1-[(2-cyclobutyloxyphenyl)methyl]-3-(3-hydroxypropyl)urea
CID 111428441
3-[(2-cyclobutyloxyphenyl)methyl]-1-[(2R)-2-cyclopropyl-2-hydroxyethyl]-1-methylurea
CID 97223766
N-[(2-cyclohexyloxyphenyl)methyl]ethanamine
CID 43277237
N-[4-[(2-cyclobutyloxyphenyl)methylamino]cyclohexyl]acetamide
CID 99634765

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide?
The IUPAC name of N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide (CID 119796176) is N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide.
What is the SMILES notation for N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide?
The canonical SMILES for N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide is CNCC(=O)NCc1ccccc1OC1CCC1.
What is the InChIKey of N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide?
The InChIKey is ROVZHJUGSCOVHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-15-10-14(17)16-9-11-5-2-3-8-13(11)18-12-6-4-7-12/h2-3,5,8,12,15H,4,6-7,9-10H2,1H3,(H,16,17).
What are the key properties of N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide?
N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.45, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide is sourced from PubChem (CID 119796176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).