2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide

C13H29N3O — CID 64710434

IUPAC2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide
SMILESCC(CC(C)(N)C(N)=O)N(C)C(C)C(C)(C)C
InChIInChI=1S/C13H29N3O/c1-9(8-13(6,15)11(14)17)16(7)10(2)12(3,4)5/h9-10H,8,15H2,1-7H3,(H2,14,17)
InChIKeyCRFWRUXGRUZURU-UHFFFAOYSA-N
MW243.39 g/mol
LogP1.33
Rot. Bonds5

About 2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide

2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide (PubChem CID 64710434) has the molecular formula C13H29N3O and a molecular weight of 243.39 g/mol. Its IUPAC name is 2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide.

Molecular Properties

Compound Name2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide
PubChem CID64710434
Molecular FormulaC13H29N3O
Molecular Weight243.39 g/mol
Exact Mass243.23
IUPAC Name2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide
SMILESCC(CC(C)(N)C(N)=O)N(C)C(C)C(C)(C)C
InChIInChI=1S/C13H29N3O/c1-9(8-13(6,15)11(14)17)16(7)10(2)12(3,4)5/h9-10H,8,15H2,1-7H3,(H2,14,17)
InChIKeyCRFWRUXGRUZURU-UHFFFAOYSA-N
XLogP1.33
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-2-methyl-4-[methyl(3-methylbutan-2-yl)amino]pentanamide
CID 64711535
(2R)-2-amino-2,4-dimethylpentanamide
CID 14037824
2-amino-4-(dimethylamino)-2-methylpentanoic acid
CID 64725828
2-amino-4-[2-ethoxyethyl(methyl)amino]-2-methylpentanamide
CID 81061651
2-amino-2-methyl-4-[methyl-(2-methylcyclohexyl)amino]pentanamide
CID 64711459
methyl 4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methyl-2-(propan-2-ylamino)pentanoate
CID 64711212
3-[3,3-dimethylbutan-2-yl(methyl)amino]-N'-hydroxybutanimidamide
CID 76912505
2-amino-2-methyl-4-[methyl-(3-methylcyclohexyl)amino]pentanamide
CID 64709478
2-amino-4-[cyclohexyl(ethyl)amino]-2-methylpentanamide
CID 64725354
N-[(2S)-3,3-dimethylbutan-2-yl]-N-ethylacetamide
CID 126737316
2-amino-2-methyl-4-pyrrolidin-1-ylpentanamide
CID 64726767
2-(15N)azanyl-2-methylbutanamide
CID 10844374

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide?
The IUPAC name of 2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide (CID 64710434) is 2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide.
What is the SMILES notation for 2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide?
The canonical SMILES for 2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide is CC(CC(C)(N)C(N)=O)N(C)C(C)C(C)(C)C.
What is the InChIKey of 2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide?
The InChIKey is CRFWRUXGRUZURU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3O/c1-9(8-13(6,15)11(14)17)16(7)10(2)12(3,4)5/h9-10H,8,15H2,1-7H3,(H2,14,17).
What are the key properties of 2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide?
2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide has a molecular weight of 243.39 g/mol, XLogP of 1.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methylpentanamide is sourced from PubChem (CID 64710434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).