5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine

C19H39N — CID 64765358

IUPAC5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine
SMILESCCCCCCCCCC(C)(C)C1CCC(C)CC1N
InChIInChI=1S/C19H39N/c1-5-6-7-8-9-10-11-14-19(3,4)17-13-12-16(2)15-18(17)20/h16-18H,5-15,20H2,1-4H3
InChIKeyQAEPAZVORQIZLU-UHFFFAOYSA-N
MW281.53 g/mol
LogP5.92
Rot. Bonds9

About 5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine

5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine (PubChem CID 64765358) has the molecular formula C19H39N and a molecular weight of 281.53 g/mol. Its IUPAC name is 5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine
PubChem CID64765358
Molecular FormulaC19H39N
Molecular Weight281.53 g/mol
Exact Mass281.31
IUPAC Name5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine
SMILESCCCCCCCCCC(C)(C)C1CCC(C)CC1N
InChIInChI=1S/C19H39N/c1-5-6-7-8-9-10-11-14-19(3,4)17-13-12-16(2)15-18(17)20/h16-18H,5-15,20H2,1-4H3
InChIKeyQAEPAZVORQIZLU-UHFFFAOYSA-N
XLogP5.92
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.53
LogP ≤ 55.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(5-ethoxy-2-methylpentan-2-yl)-5-methylcyclohexan-1-amine
CID 65177960
5-methyl-2-(2-methylnonan-2-yl)cyclohexan-1-ol
CID 64766694
N,5-dimethyl-2-(2-methyldecan-2-yl)cyclohexan-1-amine
CID 64764075
5-methyl-2-[2-methyl-5-(oxolan-2-yl)pentan-2-yl]cyclohexan-1-amine
CID 65165198
1-(2-methyloctan-2-yl)-2-undecylcyclopropane
CID 153337424
2-(2,4-dimethylhexan-2-yl)-5-methylcyclohexan-1-amine
CID 64765342
azane;1-(2-methyloctadecan-2-yl)-2-octylcyclopropane
CID 175336315
2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine
CID 64765709
2-[2-(4-ethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine
CID 64765549
2-hexyl-4-methylcyclohexan-1-amine
CID 55221311
2-dodecyl-4-methylcyclohexan-1-amine
CID 63403347
2,4-dimethylcyclohexan-1-amine;dodecane
CID 174680887

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine?
The IUPAC name of 5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine (CID 64765358) is 5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine.
What is the SMILES notation for 5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine?
The canonical SMILES for 5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine is CCCCCCCCCC(C)(C)C1CCC(C)CC1N.
What is the InChIKey of 5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine?
The InChIKey is QAEPAZVORQIZLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H39N/c1-5-6-7-8-9-10-11-14-19(3,4)17-13-12-16(2)15-18(17)20/h16-18H,5-15,20H2,1-4H3.
What are the key properties of 5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine?
5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine has a molecular weight of 281.53 g/mol, XLogP of 5.92, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine is sourced from PubChem (CID 64765358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).