3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide

C15H22N2O — CID 115267528

IUPAC3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide
SMILESCNCC1(CNC(=O)c2cccc(C)c2)CCC1
InChIInChI=1S/C15H22N2O/c1-12-5-3-6-13(9-12)14(18)17-11-15(10-16-2)7-4-8-15/h3,5-6,9,16H,4,7-8,10-11H2,1-2H3,(H,17,18)
InChIKeyQXBWXMLHMUKTLC-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.11
Rot. Bonds5

About 3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide

3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide (PubChem CID 115267528) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide.

Molecular Properties

Compound Name3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide
PubChem CID115267528
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide
SMILESCNCC1(CNC(=O)c2cccc(C)c2)CCC1
InChIInChI=1S/C15H22N2O/c1-12-5-3-6-13(9-12)14(18)17-11-15(10-16-2)7-4-8-15/h3,5-6,9,16H,4,7-8,10-11H2,1-2H3,(H,17,18)
InChIKeyQXBWXMLHMUKTLC-UHFFFAOYSA-N
XLogP2.11
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-hydroxycyclohexyl)methyl]-3-methylbenzamide
CID 64868051
3,4-difluoro-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide
CID 115267549
N-[2-[(1-hydroxycyclobutyl)methylamino]-2-oxoethyl]-3-methylbenzamide
CID 111696598
3-methyl-N-[4-[1-(methylamino)cyclopentyl]butyl]benzamide
CID 130285469
2-(3-fluorophenyl)-N-[[1-(methylaminomethyl)cyclobutyl]methyl]acetamide
CID 115267551
2-(3-bromophenyl)-N-[[1-(methylaminomethyl)cyclobutyl]methyl]acetamide
CID 115267561
N-methyl-1-[1-[(3-methylphenyl)methyl]cyclopentyl]methanamine
CID 62724183
N-[1-(hydroxymethyl)cyclohexyl]-3-methylbenzamide
CID 62520382
3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]thiophene-2-carboxamide
CID 115272118
4-bromo-N-[[1-(methylaminomethyl)cyclopropyl]methyl]benzamide
CID 115267378
2-[1-[(3-methylbenzoyl)amino]cyclobutyl]acetic acid
CID 79848230
3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide
CID 115362491

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide?
The IUPAC name of 3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide (CID 115267528) is 3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide.
What is the SMILES notation for 3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide?
The canonical SMILES for 3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide is CNCC1(CNC(=O)c2cccc(C)c2)CCC1.
What is the InChIKey of 3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide?
The InChIKey is QXBWXMLHMUKTLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12-5-3-6-13(9-12)14(18)17-11-15(10-16-2)7-4-8-15/h3,5-6,9,16H,4,7-8,10-11H2,1-2H3,(H,17,18).
What are the key properties of 3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide?
3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide has a molecular weight of 246.35 g/mol, XLogP of 2.11, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]benzamide is sourced from PubChem (CID 115267528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).