N-cyclobutyl-N-methyl-3-(methylamino)benzamide

C13H18N2O — CID 115160881

IUPACN-cyclobutyl-N-methyl-3-(methylamino)benzamide
SMILESCNc1cccc(C(=O)N(C)C2CCC2)c1
InChIInChI=1S/C13H18N2O/c1-14-11-6-3-5-10(9-11)13(16)15(2)12-7-4-8-12/h3,5-6,9,12,14H,4,7-8H2,1-2H3
InChIKeyOIZSVQCGPMLORZ-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.35
Rot. Bonds3

About N-cyclobutyl-N-methyl-3-(methylamino)benzamide

N-cyclobutyl-N-methyl-3-(methylamino)benzamide (PubChem CID 115160881) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is N-cyclobutyl-N-methyl-3-(methylamino)benzamide.

Molecular Properties

Compound NameN-cyclobutyl-N-methyl-3-(methylamino)benzamide
PubChem CID115160881
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC NameN-cyclobutyl-N-methyl-3-(methylamino)benzamide
SMILESCNc1cccc(C(=O)N(C)C2CCC2)c1
InChIInChI=1S/C13H18N2O/c1-14-11-6-3-5-10(9-11)13(16)15(2)12-7-4-8-12/h3,5-6,9,12,14H,4,7-8H2,1-2H3
InChIKeyOIZSVQCGPMLORZ-UHFFFAOYSA-N
XLogP2.35
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(carbamoylamino)-N-cyclopentyl-N-methylbenzamide
CID 47128702
N-cyclopropyl-3-hydrazinyl-N-methylbenzamide
CID 91201306
N-cyclohexyl-3-(methanesulfonamido)-N-methylbenzamide
CID 51274732
N-(cyclobutylmethyl)-N-methyl-3-(methylamino)benzamide
CID 115160920
3-bromo-N-cyclopentyl-N-methylbenzamide
CID 43213208
3-(carbamoylamino)-N-cyclopropyl-N-methylbenzamide
CID 47415616
3-bromo-N-cyclohexyl-N-methylbenzamide
CID 19166286
N-cyclopentyl-3-hydroxy-N-methylbenzamide
CID 43243153
3-(benzenesulfonamido)-N-cyclohexyl-N-methylbenzamide
CID 27670732
N,N-dimethyl-3-(methylamino)benzamide;ethane
CID 91408702
N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide
CID 110744271
N-cyclohexyl-3-ethyl-N-methylbenzamide
CID 70929086

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-N-methyl-3-(methylamino)benzamide?
The IUPAC name of N-cyclobutyl-N-methyl-3-(methylamino)benzamide (CID 115160881) is N-cyclobutyl-N-methyl-3-(methylamino)benzamide.
What is the SMILES notation for N-cyclobutyl-N-methyl-3-(methylamino)benzamide?
The canonical SMILES for N-cyclobutyl-N-methyl-3-(methylamino)benzamide is CNc1cccc(C(=O)N(C)C2CCC2)c1.
What is the InChIKey of N-cyclobutyl-N-methyl-3-(methylamino)benzamide?
The InChIKey is OIZSVQCGPMLORZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-14-11-6-3-5-10(9-11)13(16)15(2)12-7-4-8-12/h3,5-6,9,12,14H,4,7-8H2,1-2H3.
What are the key properties of N-cyclobutyl-N-methyl-3-(methylamino)benzamide?
N-cyclobutyl-N-methyl-3-(methylamino)benzamide has a molecular weight of 218.30 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-N-methyl-3-(methylamino)benzamide is sourced from PubChem (CID 115160881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).