5-amino-3-methyl-5-(4-methylphenyl)pentanamide

C13H20N2O — CID 62934157

IUPAC5-amino-3-methyl-5-(4-methylphenyl)pentanamide
SMILESCc1ccc(C(N)CC(C)CC(N)=O)cc1
InChIInChI=1S/C13H20N2O/c1-9-3-5-11(6-4-9)12(14)7-10(2)8-13(15)16/h3-6,10,12H,7-8,14H2,1-2H3,(H2,15,16)
InChIKeyVULWLRCUMYQNKI-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.90
Rot. Bonds5

About 5-amino-3-methyl-5-(4-methylphenyl)pentanamide

5-amino-3-methyl-5-(4-methylphenyl)pentanamide (PubChem CID 62934157) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 5-amino-3-methyl-5-(4-methylphenyl)pentanamide.

Molecular Properties

Compound Name5-amino-3-methyl-5-(4-methylphenyl)pentanamide
PubChem CID62934157
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name5-amino-3-methyl-5-(4-methylphenyl)pentanamide
SMILESCc1ccc(C(N)CC(C)CC(N)=O)cc1
InChIInChI=1S/C13H20N2O/c1-9-3-5-11(6-4-9)12(14)7-10(2)8-13(15)16/h3-6,10,12H,7-8,14H2,1-2H3,(H2,15,16)
InChIKeyVULWLRCUMYQNKI-UHFFFAOYSA-N
XLogP1.90
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-amino-3-methyl-5-[4-(2-methylbutan-2-yl)phenyl]pentanamide
CID 66259950
5-amino-3-methyl-5-(5-methylthiophen-2-yl)pentanamide
CID 62933991
5-amino-3-methyl-5-(2-oxo-1,3-dihydrobenzimidazol-5-yl)pentanamide
CID 62935017
5-amino-5-(2,3-dioxo-1,4-dihydroquinoxalin-6-yl)-3-methylpentanamide
CID 62933997
5-amino-5-(3-bromo-4-methoxyphenyl)-3-methylpentanamide
CID 62941286
5-amino-5-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-methylpentanamide
CID 62941476
(3S)-3-amino-3-(4-propan-2-ylphenyl)propanamide
CID 29059873
(3R)-3-amino-3-(4-methylphenyl)propane-1,1-diol
CID 163794645
5-amino-5-(4-fluorophenyl)-3-methylpentanoic acid
CID 62935345
5-amino-3-methyl-5-thiophen-2-ylpentanamide
CID 62933995
5-amino-5-(3,4-dimethylphenyl)-3-methylpentanoic acid
CID 62941465
methyl 3-amino-3-(4-methylphenyl)propanoate
CID 2769473

Frequently Asked Questions

What is the IUPAC name of 5-amino-3-methyl-5-(4-methylphenyl)pentanamide?
The IUPAC name of 5-amino-3-methyl-5-(4-methylphenyl)pentanamide (CID 62934157) is 5-amino-3-methyl-5-(4-methylphenyl)pentanamide.
What is the SMILES notation for 5-amino-3-methyl-5-(4-methylphenyl)pentanamide?
The canonical SMILES for 5-amino-3-methyl-5-(4-methylphenyl)pentanamide is Cc1ccc(C(N)CC(C)CC(N)=O)cc1.
What is the InChIKey of 5-amino-3-methyl-5-(4-methylphenyl)pentanamide?
The InChIKey is VULWLRCUMYQNKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-9-3-5-11(6-4-9)12(14)7-10(2)8-13(15)16/h3-6,10,12H,7-8,14H2,1-2H3,(H2,15,16).
What are the key properties of 5-amino-3-methyl-5-(4-methylphenyl)pentanamide?
5-amino-3-methyl-5-(4-methylphenyl)pentanamide has a molecular weight of 220.32 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-methyl-5-(4-methylphenyl)pentanamide is sourced from PubChem (CID 62934157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).