N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine

C16H33N — CID 103965730

IUPACN-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine
SMILESCCC(CC)CNC1CC(C)(C)CC(C)(C)C1
InChIInChI=1S/C16H33N/c1-7-13(8-2)11-17-14-9-15(3,4)12-16(5,6)10-14/h13-14,17H,7-12H2,1-6H3
InChIKeyASZYDIUAXNQHEB-UHFFFAOYSA-N
MW239.45 g/mol
LogP4.62
Rot. Bonds5

About N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine

N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine (PubChem CID 103965730) has the molecular formula C16H33N and a molecular weight of 239.45 g/mol. Its IUPAC name is N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine
PubChem CID103965730
Molecular FormulaC16H33N
Molecular Weight239.45 g/mol
Exact Mass239.26
IUPAC NameN-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine
SMILESCCC(CC)CNC1CC(C)(C)CC(C)(C)C1
InChIInChI=1S/C16H33N/c1-7-13(8-2)11-17-14-9-15(3,4)12-16(5,6)10-14/h13-14,17H,7-12H2,1-6H3
InChIKeyASZYDIUAXNQHEB-UHFFFAOYSA-N
XLogP4.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.45
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-ethylbutyl)-2,2,6,6-tetramethylpiperidin-4-amine
CID 28674811
1,1-difluoro-3-[(3,3,5,5-tetramethylcyclohexyl)amino]propan-2-ol
CID 103991359
2-methyl-3-[(3,3,5,5-tetramethylcyclohexyl)amino]propanoic acid
CID 103966158
methyl 2-methyl-3-[(3,3,5,5-tetramethylcyclohexyl)amino]propanoate
CID 113359608
3,3,5,5-tetramethyl-N-pentylcyclohexan-1-amine
CID 112681822
1-propan-2-yloxy-3-[(3,3,5,5-tetramethylcyclohexyl)amino]propan-2-ol
CID 103966285
methyl 2-bromo-3-[(3,3,5,5-tetramethylcyclohexyl)amino]propanoate
CID 103263743
1-N-(3,3-dimethylcyclopentyl)butane-1,2-diamine
CID 114547491
3,3,5,5-tetramethyl-N-(2-methylidenebutyl)cyclohexan-1-amine
CID 103966203
3-N-ethyl-1,5,5-trimethylcyclohexane-1,3-diamine
CID 67708166
3,3,3-trifluoro-N'-hydroxy-2-[[(3,3,5,5-tetramethylcyclohexyl)amino]methyl]propanimidamide
CID 103370117
1-(2-chlorophenyl)-2-[(3,3,5,5-tetramethylcyclohexyl)amino]ethanol
CID 103966216

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine?
The IUPAC name of N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine (CID 103965730) is N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine.
What is the SMILES notation for N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine?
The canonical SMILES for N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine is CCC(CC)CNC1CC(C)(C)CC(C)(C)C1.
What is the InChIKey of N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine?
The InChIKey is ASZYDIUAXNQHEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N/c1-7-13(8-2)11-17-14-9-15(3,4)12-16(5,6)10-14/h13-14,17H,7-12H2,1-6H3.
What are the key properties of N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine?
N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine has a molecular weight of 239.45 g/mol, XLogP of 4.62, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylbutyl)-3,3,5,5-tetramethylcyclohexan-1-amine is sourced from PubChem (CID 103965730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).