6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine

C14H25N — CID 118357210

IUPAC6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine
SMILESCC(C)C1=CC(C2CCCCC2)NCC1
InChIInChI=1S/C14H25N/c1-11(2)13-8-9-15-14(10-13)12-6-4-3-5-7-12/h10-12,14-15H,3-9H2,1-2H3
InChIKeyGIRBCNHOFATVSA-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.51
Rot. Bonds2

About 6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine

6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine (PubChem CID 118357210) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine.

Molecular Properties

Compound Name6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine
PubChem CID118357210
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine
SMILESCC(C)C1=CC(C2CCCCC2)NCC1
InChIInChI=1S/C14H25N/c1-11(2)13-8-9-15-14(10-13)12-6-4-3-5-7-12/h10-12,14-15H,3-9H2,1-2H3
InChIKeyGIRBCNHOFATVSA-UHFFFAOYSA-N
XLogP3.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.51
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 6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine?
The IUPAC name of 6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine (CID 118357210) is 6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine.
What is the SMILES notation for 6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine?
The canonical SMILES for 6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine is CC(C)C1=CC(C2CCCCC2)NCC1.
What is the InChIKey of 6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine?
The InChIKey is GIRBCNHOFATVSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-11(2)13-8-9-15-14(10-13)12-6-4-3-5-7-12/h10-12,14-15H,3-9H2,1-2H3.
What are the key properties of 6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine?
6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine has a molecular weight of 207.36 g/mol, XLogP of 3.51, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine is sourced from PubChem (CID 118357210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).