3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide

C19H20FNO2 — CID 110444038

IUPAC3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide
SMILESCOc1ccccc1C1(CNC(=O)c2cccc(F)c2)CCC1
InChIInChI=1S/C19H20FNO2/c1-23-17-9-3-2-8-16(17)19(10-5-11-19)13-21-18(22)14-6-4-7-15(20)12-14/h2-4,6-9,12H,5,10-11,13H2,1H3,(H,21,22)
InChIKeyPBACSZZMOUDHQL-UHFFFAOYSA-N
MW313.37 g/mol
LogP3.69
Rot. Bonds5

About 3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide

3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide (PubChem CID 110444038) has the molecular formula C19H20FNO2 and a molecular weight of 313.37 g/mol. Its IUPAC name is 3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide.

Molecular Properties

Compound Name3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide
PubChem CID110444038
Molecular FormulaC19H20FNO2
Molecular Weight313.37 g/mol
Exact Mass313.15
IUPAC Name3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide
SMILESCOc1ccccc1C1(CNC(=O)c2cccc(F)c2)CCC1
InChIInChI=1S/C19H20FNO2/c1-23-17-9-3-2-8-16(17)19(10-5-11-19)13-21-18(22)14-6-4-7-15(20)12-14/h2-4,6-9,12H,5,10-11,13H2,1H3,(H,21,22)
InChIKeyPBACSZZMOUDHQL-UHFFFAOYSA-N
XLogP3.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.37
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]benzamide
CID 42265812
2-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide
CID 110444105
N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]pyridine-4-carboxamide
CID 110444850
methyl N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]carbamate
CID 110477745
3-bromo-N-[[4-(2-methoxyphenyl)oxan-4-yl]methyl]benzamide
CID 27449390
3-chloro-N-[[4-(2-methoxyphenyl)oxan-4-yl]methyl]benzamide
CID 27449405
2-(2-methoxyphenyl)-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]acetamide
CID 110446469
N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide
CID 110441312
N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]-2-oxopropanamide
CID 110478355
3-fluoro-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]benzamide
CID 42265593
3,4-dimethoxy-N-[[4-(2-methoxyphenyl)oxan-4-yl]methyl]benzamide
CID 27449461
1-[[1-(2-methoxyphenyl)cyclobutyl]methyl]-3-phenylurea
CID 110446753

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide?
The IUPAC name of 3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide (CID 110444038) is 3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide.
What is the SMILES notation for 3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide?
The canonical SMILES for 3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide is COc1ccccc1C1(CNC(=O)c2cccc(F)c2)CCC1.
What is the InChIKey of 3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide?
The InChIKey is PBACSZZMOUDHQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO2/c1-23-17-9-3-2-8-16(17)19(10-5-11-19)13-21-18(22)14-6-4-7-15(20)12-14/h2-4,6-9,12H,5,10-11,13H2,1H3,(H,21,22).
What are the key properties of 3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide?
3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide has a molecular weight of 313.37 g/mol, XLogP of 3.69, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]benzamide is sourced from PubChem (CID 110444038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).