N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide

C20H23NO2 — CID 33068095

IUPACN-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide
SMILESCOCc1ccccc1CNC(=O)C1(c2ccccc2)CCC1
InChIInChI=1S/C20H23NO2/c1-23-15-17-9-6-5-8-16(17)14-21-19(22)20(12-7-13-20)18-10-3-2-4-11-18/h2-6,8-11H,7,12-15H2,1H3,(H,21,22)
InChIKeyIRLMLJRQCRUUHF-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.57
Rot. Bonds6

About N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide

N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide (PubChem CID 33068095) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide
PubChem CID33068095
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC NameN-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide
SMILESCOCc1ccccc1CNC(=O)C1(c2ccccc2)CCC1
InChIInChI=1S/C20H23NO2/c1-23-15-17-9-6-5-8-16(17)14-21-19(22)20(12-7-13-20)18-10-3-2-4-11-18/h2-6,8-11H,7,12-15H2,1H3,(H,21,22)
InChIKeyIRLMLJRQCRUUHF-UHFFFAOYSA-N
XLogP3.57
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 ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide
CID 4644139
N-[2-(2-methylpropanoylamino)ethyl]-1-phenylcyclobutane-1-carboxamide
CID 24666491
N-(methoxymethyl)-1-phenylcyclopropane-1-carboxamide
CID 50941599
1-phenyl-N-[[2-(trifluoromethyl)phenyl]methyl]cyclopentane-1-carboxamide
CID 3527303
N-ethyl-1-phenylcyclopentane-1-carboxamide
CID 778764
N-(cyclopropylmethyl)-1-phenylcyclobutane-1-carboxamide
CID 34832176
1-[[2-(hydroxymethyl)phenyl]methyl]-3-[[2-(methoxymethyl)phenyl]methyl]urea
CID 110924335
N-(1-methoxypropan-2-yl)-1-phenylcyclobutane-1-carboxamide
CID 134057156
2-methyl-3-[(1-phenylcyclobutanecarbonyl)amino]propanoic acid
CID 55105160
N-[(4-chlorophenyl)methyl]-1-phenylcyclopentane-1-carboxamide
CID 35571496
2-methoxy-N-[[2-(methoxymethyl)phenyl]methyl]acetamide
CID 60737939
N-[(2-fluorophenyl)methyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 113198405

Frequently Asked Questions

What is the IUPAC name of N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide?
The IUPAC name of N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide (CID 33068095) is N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide.
What is the SMILES notation for N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide?
The canonical SMILES for N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide is COCc1ccccc1CNC(=O)C1(c2ccccc2)CCC1.
What is the InChIKey of N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide?
The InChIKey is IRLMLJRQCRUUHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-23-15-17-9-6-5-8-16(17)14-21-19(22)20(12-7-13-20)18-10-3-2-4-11-18/h2-6,8-11H,7,12-15H2,1H3,(H,21,22).
What are the key properties of N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide?
N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide has a molecular weight of 309.41 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide is sourced from PubChem (CID 33068095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).