N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide

C15H21NO2 — CID 110441312

IUPACN-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide
SMILESCCC(=O)NCC1(c2ccccc2OC)CCC1
InChIInChI=1S/C15H21NO2/c1-3-14(17)16-11-15(9-6-10-15)12-7-4-5-8-13(12)18-2/h4-5,7-8H,3,6,9-11H2,1-2H3,(H,16,17)
InChIKeyIKKQMPJDUMMDCF-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.64
Rot. Bonds5

About N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide

N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide (PubChem CID 110441312) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide.

Molecular Properties

Compound NameN-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide
PubChem CID110441312
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC NameN-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide
SMILESCCC(=O)NCC1(c2ccccc2OC)CCC1
InChIInChI=1S/C15H21NO2/c1-3-14(17)16-11-15(9-6-10-15)12-7-4-5-8-13(12)18-2/h4-5,7-8H,3,6,9-11H2,1-2H3,(H,16,17)
InChIKeyIKKQMPJDUMMDCF-UHFFFAOYSA-N
XLogP2.64
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methoxyphenyl)-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]acetamide
CID 110446469
methyl N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]carbamate
CID 110477745
N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]-2-oxopropanamide
CID 110478355
1-[[1-(2-methoxyphenyl)cyclobutyl]methyl]-3-phenylurea
CID 110446753
1,1-diethyl-3-[[1-(2-methoxyphenyl)cyclopentyl]methyl]urea
CID 110445118
2-(4-aminophenyl)-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]acetamide;hydrochloride
CID 119747038
2-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide
CID 110444105
1-(4-chlorophenyl)-3-[[1-(2-methoxyphenyl)cyclobutyl]methyl]urea
CID 110446818
N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-N',N'-dipropylpentanediamide
CID 56552338
2-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-3-methylpentanamide
CID 119747072
N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-2-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 138034178
N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide
CID 60612311

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide?
The IUPAC name of N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide (CID 110441312) is N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide.
What is the SMILES notation for N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide?
The canonical SMILES for N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide is CCC(=O)NCC1(c2ccccc2OC)CCC1.
What is the InChIKey of N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide?
The InChIKey is IKKQMPJDUMMDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-3-14(17)16-11-15(9-6-10-15)12-7-4-5-8-13(12)18-2/h4-5,7-8H,3,6,9-11H2,1-2H3,(H,16,17).
What are the key properties of N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide?
N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide has a molecular weight of 247.34 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide is sourced from PubChem (CID 110441312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).