5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide

C14H22N2O — CID 82683861

IUPAC5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide
SMILESCc1ccc(C)c(NC(=O)CCC(C)CN)c1
InChIInChI=1S/C14H22N2O/c1-10-4-6-12(3)13(8-10)16-14(17)7-5-11(2)9-15/h4,6,8,11H,5,7,9,15H2,1-3H3,(H,16,17)
InChIKeyNMNPXMCRUFLGMK-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.62
Rot. Bonds5

About 5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide

5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide (PubChem CID 82683861) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide.

Molecular Properties

Compound Name5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide
PubChem CID82683861
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide
SMILESCc1ccc(C)c(NC(=O)CCC(C)CN)c1
InChIInChI=1S/C14H22N2O/c1-10-4-6-12(3)13(8-10)16-14(17)7-5-11(2)9-15/h4,6,8,11H,5,7,9,15H2,1-3H3,(H,16,17)
InChIKeyNMNPXMCRUFLGMK-UHFFFAOYSA-N
XLogP2.62
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-(2,5-dimethylphenyl)pentanamide;hydrochloride
CID 120558604
5-amino-N-(4-hydroxy-2-methylphenyl)-4-methylpentanamide
CID 82689437
5-amino-N-(4,5-dimethoxy-2-methylphenyl)-4-methylpentanamide
CID 82012097
N-(2,5-dimethylphenyl)-3-(3-methylbutylamino)propanamide
CID 109032011
5-amino-N-(4-fluoro-2-methylphenyl)-4-methylpentanamide
CID 82016801
3-amino-N-(2,5-dimethylphenyl)butanamide
CID 60835673
3-(aminomethyl)-N-(2,5-dimethylphenyl)hexanamide
CID 112516019
6-amino-N-(5-iodo-2-methylphenyl)-4-methylhexanamide
CID 114257291
5-amino-4-methyl-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide
CID 82013593
N-(2,4-dimethylphenyl)-4-methylpentanamide
CID 78775203
5-amino-N-(2,4-dimethyl-5-nitrophenyl)-4-methylpentanamide
CID 104757782
5-(2,5-dimethylanilino)-3-methyl-5-oxopentanoic acid
CID 62965721

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide?
The IUPAC name of 5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide (CID 82683861) is 5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide.
What is the SMILES notation for 5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide?
The canonical SMILES for 5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide is Cc1ccc(C)c(NC(=O)CCC(C)CN)c1.
What is the InChIKey of 5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide?
The InChIKey is NMNPXMCRUFLGMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-10-4-6-12(3)13(8-10)16-14(17)7-5-11(2)9-15/h4,6,8,11H,5,7,9,15H2,1-3H3,(H,16,17).
What are the key properties of 5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide?
5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide has a molecular weight of 234.34 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide is sourced from PubChem (CID 82683861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).