6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide

C14H30N2O — CID 114100113

IUPAC6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide
SMILESCC(CCN)CCC(=O)NCC(C)(C)C(C)C
InChIInChI=1S/C14H30N2O/c1-11(2)14(4,5)10-16-13(17)7-6-12(3)8-9-15/h11-12H,6-10,15H2,1-5H3,(H,16,17)
InChIKeyBPMZYMPCLVYUPC-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.55
Rot. Bonds8

About 6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide

6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide (PubChem CID 114100113) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide.

Molecular Properties

Compound Name6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide
PubChem CID114100113
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide
SMILESCC(CCN)CCC(=O)NCC(C)(C)C(C)C
InChIInChI=1S/C14H30N2O/c1-11(2)14(4,5)10-16-13(17)7-6-12(3)8-9-15/h11-12H,6-10,15H2,1-5H3,(H,16,17)
InChIKeyBPMZYMPCLVYUPC-UHFFFAOYSA-N
XLogP2.55
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide 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

6-amino-4-methyl-N-(4,4,4-trifluorobutyl)hexanamide
CID 113327466
ethyl 3-oxo-3-(2,2,3-trimethylbutylamino)propanoate
CID 115138675
6-amino-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-4-methylhexanamide
CID 107852731
2-[(6-amino-4-methylhexanoyl)amino]ethyl carbamate
CID 83210194
6-amino-N-[(1R)-1-cyclopentylethyl]-4-methylhexanamide
CID 81390503
6-amino-N-(2,2-diethoxyethyl)-4-methylhexanamide
CID 79547447
6-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]-4-methylhexanamide
CID 83110420
6-amino-4-methyl-N-methylsulfonylhexanamide
CID 103287350
6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide
CID 66005084
2-[[(6-amino-4-methylhexanoyl)amino]methyl]pentanoic acid
CID 65223888
6-amino-N-[(4-ethylphenyl)methyl]-4-methylhexanamide
CID 106899790
5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide
CID 106148529

Frequently Asked Questions

What is the IUPAC name of 6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide?
The IUPAC name of 6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide (CID 114100113) is 6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide.
What is the SMILES notation for 6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide?
The canonical SMILES for 6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide is CC(CCN)CCC(=O)NCC(C)(C)C(C)C.
What is the InChIKey of 6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide?
The InChIKey is BPMZYMPCLVYUPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-11(2)14(4,5)10-16-13(17)7-6-12(3)8-9-15/h11-12H,6-10,15H2,1-5H3,(H,16,17).
What are the key properties of 6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide?
6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide has a molecular weight of 242.41 g/mol, XLogP of 2.55, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4-methyl-N-(2,2,3-trimethylbutyl)hexanamide is sourced from PubChem (CID 114100113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).