2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine

C17H33N — CID 63452484

IUPAC2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine
SMILESCC(C)(C)CNC1CCCCC1C1CCCCC1
InChIInChI=1S/C17H33N/c1-17(2,3)13-18-16-12-8-7-11-15(16)14-9-5-4-6-10-14/h14-16,18H,4-13H2,1-3H3
InChIKeyOOSPCOMZJZPLAB-UHFFFAOYSA-N
MW251.46 g/mol
LogP4.76
Rot. Bonds3

About 2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine

2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine (PubChem CID 63452484) has the molecular formula C17H33N and a molecular weight of 251.46 g/mol. Its IUPAC name is 2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine
PubChem CID63452484
Molecular FormulaC17H33N
Molecular Weight251.46 g/mol
Exact Mass251.26
IUPAC Name2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine
SMILESCC(C)(C)CNC1CCCCC1C1CCCCC1
InChIInChI=1S/C17H33N/c1-17(2,3)13-18-16-12-8-7-11-15(16)14-9-5-4-6-10-14/h14-16,18H,4-13H2,1-3H3
InChIKeyOOSPCOMZJZPLAB-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.46
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine?
The IUPAC name of 2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine (CID 63452484) is 2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine.
What is the SMILES notation for 2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine?
The canonical SMILES for 2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine is CC(C)(C)CNC1CCCCC1C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine?
The InChIKey is OOSPCOMZJZPLAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N/c1-17(2,3)13-18-16-12-8-7-11-15(16)14-9-5-4-6-10-14/h14-16,18H,4-13H2,1-3H3.
What are the key properties of 2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine?
2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine has a molecular weight of 251.46 g/mol, XLogP of 4.76, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine is sourced from PubChem (CID 63452484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).