3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide

C20H23NO2 — CID 51316458

IUPAC3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide
SMILESCOCc1cccc(C(=O)NCC2(c3ccccc3)CCC2)c1
InChIInChI=1S/C20H23NO2/c1-23-14-16-7-5-8-17(13-16)19(22)21-15-20(11-6-12-20)18-9-3-2-4-10-18/h2-5,7-10,13H,6,11-12,14-15H2,1H3,(H,21,22)
InChIKeyAGAKPLFQQYPJFK-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.68
Rot. Bonds6

About 3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide

3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide (PubChem CID 51316458) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is 3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide.

Molecular Properties

Compound Name3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide
PubChem CID51316458
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide
SMILESCOCc1cccc(C(=O)NCC2(c3ccccc3)CCC2)c1
InChIInChI=1S/C20H23NO2/c1-23-14-16-7-5-8-17(13-16)19(22)21-15-20(11-6-12-20)18-9-3-2-4-10-18/h2-5,7-10,13H,6,11-12,14-15H2,1H3,(H,21,22)
InChIKeyAGAKPLFQQYPJFK-UHFFFAOYSA-N
XLogP3.68
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(dimethylamino)-N-[(1-phenylcyclopentyl)methyl]benzamide
CID 24564777
N-ethyl-3-[[[N'-methyl-N-[(1-phenylcyclobutyl)methyl]carbamimidoyl]amino]methyl]benzamide
CID 111854808
2-[1-[[3-(methoxymethyl)benzoyl]amino]cyclobutyl]acetic acid
CID 79848221
5-(methoxymethyl)-N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide
CID 86918294
3-(methoxymethyl)-N-propylbenzamide
CID 60667721
N-(1-adamantylmethyl)-3-(methoxymethyl)benzamide
CID 28538241
3-chloro-N-[(1-phenylcyclopropyl)methyl]benzamide
CID 18153649
N-[(1-hydroxy-3-methylcyclohexyl)methyl]-3-(methoxymethyl)benzamide
CID 65124255
4-amino-N-[(1-phenylcyclobutyl)methyl]benzamide
CID 110462616
N-[2-oxo-2-[(1-phenylcyclobutyl)methylamino]ethyl]benzamide
CID 46691539
N-methyl-3-[[[N'-methyl-N-[(1-phenylcyclopentyl)methyl]carbamimidoyl]amino]methyl]benzamide
CID 111852772
3-(ethylsulfamoyl)-N-[(1-phenylcyclopropyl)methyl]benzamide
CID 55523331

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide?
The IUPAC name of 3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide (CID 51316458) is 3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide.
What is the SMILES notation for 3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide?
The canonical SMILES for 3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide is COCc1cccc(C(=O)NCC2(c3ccccc3)CCC2)c1.
What is the InChIKey of 3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide?
The InChIKey is AGAKPLFQQYPJFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-23-14-16-7-5-8-17(13-16)19(22)21-15-20(11-6-12-20)18-9-3-2-4-10-18/h2-5,7-10,13H,6,11-12,14-15H2,1H3,(H,21,22).
What are the key properties of 3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide?
3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide has a molecular weight of 309.41 g/mol, XLogP of 3.68, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-N-[(1-phenylcyclobutyl)methyl]benzamide is sourced from PubChem (CID 51316458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).