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

C14H25N — CID 140915837

IUPAC2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine
SMILESCC(C)C1=CCNC(C2CCCCC2)C1
InChIInChI=1S/C14H25N/c1-11(2)13-8-9-15-14(10-13)12-6-4-3-5-7-12/h8,11-12,14-15H,3-7,9-10H2,1-2H3
InChIKeySANXADVUTVLZHS-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.51
Rot. Bonds2

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

2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine (PubChem CID 140915837) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine.

Molecular Properties

Compound Name2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine
PubChem CID140915837
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine
SMILESCC(C)C1=CCNC(C2CCCCC2)C1
InChIInChI=1S/C14H25N/c1-11(2)13-8-9-15-14(10-13)12-6-4-3-5-7-12/h8,11-12,14-15H,3-7,9-10H2,1-2H3
InChIKeySANXADVUTVLZHS-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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Related Compounds

2-cyclohexyl-4-ethyl-1,2,3,6-tetrahydropyridine
CID 146557976
2-cyclohexylaziridine
CID 14342017
2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-cyclohepta[b]pyridine;ethane
CID 142196659
4-propan-2-yl-1,2,3,6-tetrahydropyridine
CID 23423759
5-cyclohexyl-2-methyl-1-(1-thiophen-3-ylethyl)piperazine
CID 64939615
2-cyclodecylazecane
CID 126739440
(2S)-2-cyclohexylpiperidine
CID 7016471
8-propan-2-yl-1,2,3,3a,4,5,6,7,8,9,10,10a-dodecahydrocyclonona[b]pyrrole
CID 166956408
3-cyclopentyl-1-propan-2-ylcyclopenta-1,3-diene
CID 159952981
2-cyclopentylpiperidin-4-one;hydrochloride
CID 115023225
3-cyclohexyl-6,8-dimethoxy-1,2,3,4-tetrahydroisoquinoline
CID 177376067
5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine
CID 64934247

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine?
The IUPAC name of 2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine (CID 140915837) is 2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine.
What is the SMILES notation for 2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine?
The canonical SMILES for 2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine is CC(C)C1=CCNC(C2CCCCC2)C1.
What is the InChIKey of 2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine?
The InChIKey is SANXADVUTVLZHS-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/h8,11-12,14-15H,3-7,9-10H2,1-2H3.
What are the key properties of 2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine?
2-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 2-cyclohexyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine is sourced from PubChem (CID 140915837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).