N-methyl-2-(methylamino)-N-pentylbenzamide

C14H22N2O — CID 61375902

IUPACN-methyl-2-(methylamino)-N-pentylbenzamide
SMILESCCCCCN(C)C(=O)c1ccccc1NC
InChIInChI=1S/C14H22N2O/c1-4-5-8-11-16(3)14(17)12-9-6-7-10-13(12)15-2/h6-7,9-10,15H,4-5,8,11H2,1-3H3
InChIKeyAVDAUOKHCRROAL-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.99
Rot. Bonds6

About N-methyl-2-(methylamino)-N-pentylbenzamide

N-methyl-2-(methylamino)-N-pentylbenzamide (PubChem CID 61375902) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-methyl-2-(methylamino)-N-pentylbenzamide.

Molecular Properties

Compound NameN-methyl-2-(methylamino)-N-pentylbenzamide
PubChem CID61375902
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-methyl-2-(methylamino)-N-pentylbenzamide
SMILESCCCCCN(C)C(=O)c1ccccc1NC
InChIInChI=1S/C14H22N2O/c1-4-5-8-11-16(3)14(17)12-9-6-7-10-13(12)15-2/h6-7,9-10,15H,4-5,8,11H2,1-3H3
InChIKeyAVDAUOKHCRROAL-UHFFFAOYSA-N
XLogP2.99
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-methyl-2-(methylamino)-N-[3-(methylamino)-3-oxopropyl]benzamide
CID 106916885
N-butyl-N-ethyl-2-(methylamino)benzamide
CID 61377458
N-methyl-2-(methylamino)-N-(3-methylbutyl)benzamide
CID 61377480
2-formyl-N-heptyl-N-methylbenzamide
CID 144774360
2-(ethylamino)-N-methyl-N-(2-phenylethyl)benzamide
CID 63108183
2-(ethylamino)-N-methyl-N-(3-methylbutyl)benzamide
CID 62177256
2-(ethylamino)-3-fluoro-N-methyl-N-pentylbenzamide
CID 62649252
N-(1-hydroxypropan-2-yl)-N-methyl-2-(methylamino)benzamide
CID 104552913
N-[(4-fluorophenyl)methyl]-N-methyl-2-(methylamino)benzamide
CID 60670598
N-butyl-N-methyl-2-(propylamino)pyridine-3-carboxamide
CID 62186071
3-fluoro-N-methyl-N-pentyl-2-(propylamino)benzamide
CID 62649253
2-ethyl-N-methyl-N-(3-methylsulfonylpropyl)benzamide
CID 84591945

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(methylamino)-N-pentylbenzamide?
The IUPAC name of N-methyl-2-(methylamino)-N-pentylbenzamide (CID 61375902) is N-methyl-2-(methylamino)-N-pentylbenzamide.
What is the SMILES notation for N-methyl-2-(methylamino)-N-pentylbenzamide?
The canonical SMILES for N-methyl-2-(methylamino)-N-pentylbenzamide is CCCCCN(C)C(=O)c1ccccc1NC.
What is the InChIKey of N-methyl-2-(methylamino)-N-pentylbenzamide?
The InChIKey is AVDAUOKHCRROAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-4-5-8-11-16(3)14(17)12-9-6-7-10-13(12)15-2/h6-7,9-10,15H,4-5,8,11H2,1-3H3.
What are the key properties of N-methyl-2-(methylamino)-N-pentylbenzamide?
N-methyl-2-(methylamino)-N-pentylbenzamide has a molecular weight of 234.34 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(methylamino)-N-pentylbenzamide is sourced from PubChem (CID 61375902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).