2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide

C15H31NO — CID 90347352

IUPAC2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide
SMILESCC(C)C(=O)NC(CCC(C)(C)C)C(C)(C)C
InChIInChI=1S/C15H31NO/c1-11(2)13(17)16-12(15(6,7)8)9-10-14(3,4)5/h11-12H,9-10H2,1-8H3,(H,16,17)
InChIKeyWJIDJYOGRKBOMR-UHFFFAOYSA-N
MW241.42 g/mol
LogP4.00
Rot. Bonds4

About 2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide

2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide (PubChem CID 90347352) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide
PubChem CID90347352
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide
SMILESCC(C)C(=O)NC(CCC(C)(C)C)C(C)(C)C
InChIInChI=1S/C15H31NO/c1-11(2)13(17)16-12(15(6,7)8)9-10-14(3,4)5/h11-12H,9-10H2,1-8H3,(H,16,17)
InChIKeyWJIDJYOGRKBOMR-UHFFFAOYSA-N
XLogP4.00
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide 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

N-[6,6-dimethyl-5-(2-methylpropanoylamino)heptyl]-2,2-dimethylpropanamide
CID 155090343
2-methylsulfonyl-N-(2,2,6,6-tetramethylheptan-3-yl)acetamide
CID 90347351
N-(2,2,7,7-tetramethyloctan-3-yl)propanamide
CID 90347364
N-[(2S)-3,3-dimethylbutan-2-yl]-2-methylpropanamide
CID 153456545
N-(2,7,7-trimethyloctan-3-yl)acetamide
CID 144535595
3,3,3-trifluoro-N-(2,2,7,7-tetramethyloctan-3-yl)propanamide
CID 90347365
(2S)-2-amino-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-4-methylpentanamide
CID 114176965
N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]-2-methyl-3-(methylamino)propanamide
CID 119888442
(2S)-2-amino-N-(5,5-dimethylhexan-2-yl)-4-methylpentanamide
CID 119796588
(2S)-3,3-dimethyl-2-(2-methylpropanoylamino)butanoic acid
CID 61143223
N-(1-chloro-4,4-dimethylpentan-3-yl)-2-propylpentanamide
CID 106355550
2-amino-N-(1-hydroxy-4,4-dimethylpentan-3-yl)butanamide
CID 106349899

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide?
The IUPAC name of 2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide (CID 90347352) is 2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide?
The canonical SMILES for 2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide is CC(C)C(=O)NC(CCC(C)(C)C)C(C)(C)C.
What is the InChIKey of 2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide?
The InChIKey is WJIDJYOGRKBOMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-11(2)13(17)16-12(15(6,7)8)9-10-14(3,4)5/h11-12H,9-10H2,1-8H3,(H,16,17).
What are the key properties of 2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide?
2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide has a molecular weight of 241.42 g/mol, XLogP of 4.00, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2,2,6,6-tetramethylheptan-3-yl)propanamide is sourced from PubChem (CID 90347352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).