10-(2-cyclohexylcyclohexyl)decan-1-amine

C22H43N — CID 174822141

IUPAC10-(2-cyclohexylcyclohexyl)decan-1-amine
SMILESNCCCCCCCCCCC1CCCCC1C1CCCCC1
InChIInChI=1S/C22H43N/c23-19-13-6-4-2-1-3-5-8-14-21-17-11-12-18-22(21)20-15-9-7-10-16-20/h20-22H,1-19,23H2
InChIKeyYMXLHALGJZGKCU-UHFFFAOYSA-N
MW321.59 g/mol
LogP6.84
Rot. Bonds11

About 10-(2-cyclohexylcyclohexyl)decan-1-amine

10-(2-cyclohexylcyclohexyl)decan-1-amine (PubChem CID 174822141) has the molecular formula C22H43N and a molecular weight of 321.59 g/mol. Its IUPAC name is 10-(2-cyclohexylcyclohexyl)decan-1-amine.

Molecular Properties

Compound Name10-(2-cyclohexylcyclohexyl)decan-1-amine
PubChem CID174822141
Molecular FormulaC22H43N
Molecular Weight321.59 g/mol
Exact Mass321.34
IUPAC Name10-(2-cyclohexylcyclohexyl)decan-1-amine
SMILESNCCCCCCCCCCC1CCCCC1C1CCCCC1
InChIInChI=1S/C22H43N/c23-19-13-6-4-2-1-3-5-8-14-21-17-11-12-18-22(21)20-15-9-7-10-16-20/h20-22H,1-19,23H2
InChIKeyYMXLHALGJZGKCU-UHFFFAOYSA-N
XLogP6.84
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.59
LogP ≤ 56.84
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

10-(2-cyclohexylcyclohexyl)decan-1-amine;guanidine
CID 174822140
1-hexyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 54214621
1-nonyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 139911728
1-(5-ethoxypentyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 90715549
3-[2-(3-aminopropyl)cyclohexyl]propan-1-amine
CID 67095749
4-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)butan-1-ol
CID 89099037
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-ylmethanamine
CID 22484494
6-cyclohexylhexan-1-amine
CID 19875455
(1R,4aS,8aR)-1-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 97184727
5-[2-(5-aminopentyl)cyclopropyl]pentan-1-amine
CID 58260208
4-cyclohexylbutan-1-amine;hydrochloride
CID 67665513
1-[2-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)ethyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;carbanide;zirconium(4+)
CID 23230200

Frequently Asked Questions

What is the IUPAC name of 10-(2-cyclohexylcyclohexyl)decan-1-amine?
The IUPAC name of 10-(2-cyclohexylcyclohexyl)decan-1-amine (CID 174822141) is 10-(2-cyclohexylcyclohexyl)decan-1-amine.
What is the SMILES notation for 10-(2-cyclohexylcyclohexyl)decan-1-amine?
The canonical SMILES for 10-(2-cyclohexylcyclohexyl)decan-1-amine is NCCCCCCCCCCC1CCCCC1C1CCCCC1.
What is the InChIKey of 10-(2-cyclohexylcyclohexyl)decan-1-amine?
The InChIKey is YMXLHALGJZGKCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H43N/c23-19-13-6-4-2-1-3-5-8-14-21-17-11-12-18-22(21)20-15-9-7-10-16-20/h20-22H,1-19,23H2.
What are the key properties of 10-(2-cyclohexylcyclohexyl)decan-1-amine?
10-(2-cyclohexylcyclohexyl)decan-1-amine has a molecular weight of 321.59 g/mol, XLogP of 6.84, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(2-cyclohexylcyclohexyl)decan-1-amine is sourced from PubChem (CID 174822141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).