N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide

C13H18N2O — CID 110744271

IUPACN-cyclopropyl-3-(dimethylamino)-N-methylbenzamide
SMILESCN(C)c1cccc(C(=O)N(C)C2CC2)c1
InChIInChI=1S/C13H18N2O/c1-14(2)12-6-4-5-10(9-12)13(16)15(3)11-7-8-11/h4-6,9,11H,7-8H2,1-3H3
InChIKeyIBYOOWHJPDBOLT-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.99
Rot. Bonds3

About N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide

N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide (PubChem CID 110744271) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(dimethylamino)-N-methylbenzamide
PubChem CID110744271
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC NameN-cyclopropyl-3-(dimethylamino)-N-methylbenzamide
SMILESCN(C)c1cccc(C(=O)N(C)C2CC2)c1
InChIInChI=1S/C13H18N2O/c1-14(2)12-6-4-5-10(9-12)13(16)15(3)11-7-8-11/h4-6,9,11H,7-8H2,1-3H3
InChIKeyIBYOOWHJPDBOLT-UHFFFAOYSA-N
XLogP1.99
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(dimethylamino)-N-methyl-N-[(1S,3R)-3-methylsulfanylcyclopentyl]benzamide
CID 95898425
3-chloro-N-cyclopropyl-N-methylbenzamide
CID 110726716
3-carbamothioyl-N-cyclopropyl-N-methylbenzamide
CID 43265122
N-cyclobutyl-N-methyl-3-(methylamino)benzamide
CID 115160881
N-cyclopropyl-3-hydrazinyl-N-methylbenzamide
CID 91201306
N-cyclopentyl-3-hydroxy-N-methylbenzamide
CID 43243153
N-(4-aminocyclohexyl)-N,3-dimethylbenzamide
CID 79121288
N-cyclopropyl-N-methyl-3-sulfamoylbenzamide
CID 43265275
3-bromo-N-cyclopentyl-N-methylbenzamide
CID 43213208
bis[3-(dimethylamino)phenyl]methanone
CID 14534104
3-(carbamoylamino)-N-cyclopropyl-N-methylbenzamide
CID 47415616
3-bromo-N-cyclohexyl-N-methylbenzamide
CID 19166286

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide?
The IUPAC name of N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide (CID 110744271) is N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide.
What is the SMILES notation for N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide?
The canonical SMILES for N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide is CN(C)c1cccc(C(=O)N(C)C2CC2)c1.
What is the InChIKey of N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide?
The InChIKey is IBYOOWHJPDBOLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-14(2)12-6-4-5-10(9-12)13(16)15(3)11-7-8-11/h4-6,9,11H,7-8H2,1-3H3.
What are the key properties of N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide?
N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide has a molecular weight of 218.30 g/mol, XLogP of 1.99, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(dimethylamino)-N-methylbenzamide is sourced from PubChem (CID 110744271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).