N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide

C19H21NO2 — CID 11119991

IUPACN-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide
SMILESCC1(CN(Cc2ccccc2)C(=O)c2ccccc2)COC1
InChIInChI=1S/C19H21NO2/c1-19(14-22-15-19)13-20(12-16-8-4-2-5-9-16)18(21)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3
InChIKeyZECHKDJNBCIJBS-UHFFFAOYSA-N
MW295.38 g/mol
LogP3.37
Rot. Bonds5

About N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide

N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide (PubChem CID 11119991) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide.

Molecular Properties

Compound NameN-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide
PubChem CID11119991
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC NameN-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide
SMILESCC1(CN(Cc2ccccc2)C(=O)c2ccccc2)COC1
InChIInChI=1S/C19H21NO2/c1-19(14-22-15-19)13-20(12-16-8-4-2-5-9-16)18(21)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3
InChIKeyZECHKDJNBCIJBS-UHFFFAOYSA-N
XLogP3.37
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-benzyl-N-methyl-N-[(3-methyloxetan-3-yl)methyl]benzamide
CID 101031048
N,N-dibenzyl-2-(6-methyl-1,4,8,11-tetraoxacyclotetradec-6-yl)acetamide
CID 10004169
N,N-bis[bis[(2-methyloxiran-2-yl)methyl]amino]benzamide
CID 88735862
N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide
CID 78956835
4-(dibenzylcarbamoyl)benzoic acid
CID 67563328
3-[benzoyl(benzyl)amino]-2-methylpropanoic acid
CID 82324559
N-benzyl-N-(oxetan-3-yl)benzamide
CID 166264927
N,N-dibenzyl-4-propan-2-ylbenzamide
CID 5101447
3-[benzyl(ethyl)carbamoyl]benzoic acid
CID 43452784
N-benzyl-N-(3-morpholin-4-ium-4-ylpropyl)benzamide chloride
CID 15345
(3-methyloxetan-3-yl)methyl 4-phenylbutanoate
CID 13123200
N,N-dibenzyl-3-(methoxymethyl)benzamide
CID 55436683

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide?
The IUPAC name of N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide (CID 11119991) is N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide.
What is the SMILES notation for N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide?
The canonical SMILES for N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide is CC1(CN(Cc2ccccc2)C(=O)c2ccccc2)COC1.
What is the InChIKey of N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide?
The InChIKey is ZECHKDJNBCIJBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2/c1-19(14-22-15-19)13-20(12-16-8-4-2-5-9-16)18(21)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3.
What are the key properties of N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide?
N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide has a molecular weight of 295.38 g/mol, XLogP of 3.37, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide is sourced from PubChem (CID 11119991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).