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

C17H31N — CID 67832040

IUPACN-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine
SMILESCC(C)(C)C=C1CCCCC1NC1CCCCC1
InChIInChI=1S/C17H31N/c1-17(2,3)13-14-9-7-8-12-16(14)18-15-10-5-4-6-11-15/h13,15-16,18H,4-12H2,1-3H3
InChIKeyHVLAMLHZWSBLSI-UHFFFAOYSA-N
MW249.44 g/mol
LogP4.82
Rot. Bonds2

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

N-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine (PubChem CID 67832040) has the molecular formula C17H31N and a molecular weight of 249.44 g/mol. Its IUPAC name is N-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine.

Molecular Properties

Compound NameN-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine
PubChem CID67832040
Molecular FormulaC17H31N
Molecular Weight249.44 g/mol
Exact Mass249.25
IUPAC NameN-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine
SMILESCC(C)(C)C=C1CCCCC1NC1CCCCC1
InChIInChI=1S/C17H31N/c1-17(2,3)13-14-9-7-8-12-16(14)18-15-10-5-4-6-11-15/h13,15-16,18H,4-12H2,1-3H3
InChIKeyHVLAMLHZWSBLSI-UHFFFAOYSA-N
XLogP4.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.44
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine?
The IUPAC name of N-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine (CID 67832040) is N-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine.
What is the SMILES notation for N-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine?
The canonical SMILES for N-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine is CC(C)(C)C=C1CCCCC1NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine?
The InChIKey is HVLAMLHZWSBLSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N/c1-17(2,3)13-14-9-7-8-12-16(14)18-15-10-5-4-6-11-15/h13,15-16,18H,4-12H2,1-3H3.
What are the key properties of N-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine?
N-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine has a molecular weight of 249.44 g/mol, XLogP of 4.82, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(2,2-dimethylpropylidene)cyclohexan-1-amine is sourced from PubChem (CID 67832040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).