1-cyclooctyl-5-methylhexan-1-amine

C15H31N — CID 83162244

IUPAC1-cyclooctyl-5-methylhexan-1-amine
SMILESCC(C)CCCC(N)C1CCCCCCC1
InChIInChI=1S/C15H31N/c1-13(2)9-8-12-15(16)14-10-6-4-3-5-7-11-14/h13-15H,3-12,16H2,1-2H3
InChIKeyZIBYTVYKUYONJR-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.50
Rot. Bonds5

About 1-cyclooctyl-5-methylhexan-1-amine

1-cyclooctyl-5-methylhexan-1-amine (PubChem CID 83162244) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 1-cyclooctyl-5-methylhexan-1-amine.

Molecular Properties

Compound Name1-cyclooctyl-5-methylhexan-1-amine
PubChem CID83162244
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name1-cyclooctyl-5-methylhexan-1-amine
SMILESCC(C)CCCC(N)C1CCCCCCC1
InChIInChI=1S/C15H31N/c1-13(2)9-8-12-15(16)14-10-6-4-3-5-7-11-14/h13-15H,3-12,16H2,1-2H3
InChIKeyZIBYTVYKUYONJR-UHFFFAOYSA-N
XLogP4.50
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-1-(4-propan-2-ylcyclohexyl)hexan-1-amine
CID 83161046
(1R)-1-cyclopentylpentan-1-amine
CID 55292231
1-cycloheptylheptan-1-amine
CID 65399314
(4S)-4-amino-4-cyclohexylbutan-1-ol
CID 102516079
1-cyclohexyl-N',N'-bis(3-methylbutyl)ethane-1,2-diamine
CID 107869689
7-methyloctan-2-ylcyclohexane
CID 54518526
1-cyclohexyl-3-propan-2-yloxypropan-1-amine
CID 114998646
5-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)hexan-1-amine
CID 112680959
1-amino-1-cyclohexyl-6-methylheptan-3-ol
CID 22367824
1-cyclohexyl-4-methoxypentan-1-amine
CID 105079909
1-cyclobutylnonan-1-amine
CID 64986616
1-cyclooctyl-3-cyclopropylpropan-1-amine
CID 80603761

Frequently Asked Questions

What is the IUPAC name of 1-cyclooctyl-5-methylhexan-1-amine?
The IUPAC name of 1-cyclooctyl-5-methylhexan-1-amine (CID 83162244) is 1-cyclooctyl-5-methylhexan-1-amine.
What is the SMILES notation for 1-cyclooctyl-5-methylhexan-1-amine?
The canonical SMILES for 1-cyclooctyl-5-methylhexan-1-amine is CC(C)CCCC(N)C1CCCCCCC1.
What is the InChIKey of 1-cyclooctyl-5-methylhexan-1-amine?
The InChIKey is ZIBYTVYKUYONJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-13(2)9-8-12-15(16)14-10-6-4-3-5-7-11-14/h13-15H,3-12,16H2,1-2H3.
What are the key properties of 1-cyclooctyl-5-methylhexan-1-amine?
1-cyclooctyl-5-methylhexan-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.50, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclooctyl-5-methylhexan-1-amine is sourced from PubChem (CID 83162244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).