2-(methylamino)-N-(4-methylpentyl)benzamide

C14H22N2O — CID 61377674

IUPAC2-(methylamino)-N-(4-methylpentyl)benzamide
SMILESCNc1ccccc1C(=O)NCCCC(C)C
InChIInChI=1S/C14H22N2O/c1-11(2)7-6-10-16-14(17)12-8-4-5-9-13(12)15-3/h4-5,8-9,11,15H,6-7,10H2,1-3H3,(H,16,17)
InChIKeyZRGLZUVLUWRRRI-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.89
Rot. Bonds6

About 2-(methylamino)-N-(4-methylpentyl)benzamide

2-(methylamino)-N-(4-methylpentyl)benzamide (PubChem CID 61377674) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(methylamino)-N-(4-methylpentyl)benzamide.

Molecular Properties

Compound Name2-(methylamino)-N-(4-methylpentyl)benzamide
PubChem CID61377674
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(methylamino)-N-(4-methylpentyl)benzamide
SMILESCNc1ccccc1C(=O)NCCCC(C)C
InChIInChI=1S/C14H22N2O/c1-11(2)7-6-10-16-14(17)12-8-4-5-9-13(12)15-3/h4-5,8-9,11,15H,6-7,10H2,1-3H3,(H,16,17)
InChIKeyZRGLZUVLUWRRRI-UHFFFAOYSA-N
XLogP2.89
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-fluoro-N-(4-methylpentyl)benzamide
CID 60738338
2-hydrazinyl-N-(3-methylbutyl)benzamide
CID 62238189
2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide
CID 113450456
3-hydrazinyl-N-(4-methylpentyl)pyridine-4-carboxamide
CID 105072134
N-methyl-2-(methylamino)-N-(3-methylbutyl)benzamide
CID 61377480
2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzamide
CID 114175674
3-[[2-(methylamino)benzoyl]amino]propyl prop-2-ynoate
CID 53468564
2-hydrazinyl-N-(5-methylhexyl)pyridine-3-carboxamide
CID 115327334
N-[2-[ethyl(methyl)amino]ethyl]-2-(methylamino)benzamide
CID 62636522
N-(3-aminopropyl)-2-(propan-2-ylamino)benzamide
CID 63107952
5-methyl-2-(methylamino)-N-(3-methylbutyl)benzamide
CID 55083223
N-[1-(dimethylamino)-4-methylpentan-2-yl]-2-(methylamino)benzamide
CID 61376334

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(4-methylpentyl)benzamide?
The IUPAC name of 2-(methylamino)-N-(4-methylpentyl)benzamide (CID 61377674) is 2-(methylamino)-N-(4-methylpentyl)benzamide.
What is the SMILES notation for 2-(methylamino)-N-(4-methylpentyl)benzamide?
The canonical SMILES for 2-(methylamino)-N-(4-methylpentyl)benzamide is CNc1ccccc1C(=O)NCCCC(C)C.
What is the InChIKey of 2-(methylamino)-N-(4-methylpentyl)benzamide?
The InChIKey is ZRGLZUVLUWRRRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11(2)7-6-10-16-14(17)12-8-4-5-9-13(12)15-3/h4-5,8-9,11,15H,6-7,10H2,1-3H3,(H,16,17).
What are the key properties of 2-(methylamino)-N-(4-methylpentyl)benzamide?
2-(methylamino)-N-(4-methylpentyl)benzamide has a molecular weight of 234.34 g/mol, XLogP of 2.89, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(4-methylpentyl)benzamide is sourced from PubChem (CID 61377674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).