1-(2-methyl-1-phenylcyclohexyl)piperidine

C18H27N — CID 3017138

IUPAC1-(2-methyl-1-phenylcyclohexyl)piperidine
SMILESCC1CCCCC1(c1ccccc1)N1CCCCC1
InChIInChI=1S/C18H27N/c1-16-10-6-7-13-18(16,17-11-4-2-5-12-17)19-14-8-3-9-15-19/h2,4-5,11-12,16H,3,6-10,13-15H2,1H3
InChIKeyCBVUKHMVMNBFQP-UHFFFAOYSA-N
MW257.42 g/mol
LogP4.58
Rot. Bonds2

About 1-(2-methyl-1-phenylcyclohexyl)piperidine

1-(2-methyl-1-phenylcyclohexyl)piperidine (PubChem CID 3017138) has the molecular formula C18H27N and a molecular weight of 257.42 g/mol. Its IUPAC name is 1-(2-methyl-1-phenylcyclohexyl)piperidine.

Molecular Properties

Compound Name1-(2-methyl-1-phenylcyclohexyl)piperidine
PubChem CID3017138
Molecular FormulaC18H27N
Molecular Weight257.42 g/mol
Exact Mass257.21
IUPAC Name1-(2-methyl-1-phenylcyclohexyl)piperidine
SMILESCC1CCCCC1(c1ccccc1)N1CCCCC1
InChIInChI=1S/C18H27N/c1-16-10-6-7-13-18(16,17-11-4-2-5-12-17)19-14-8-3-9-15-19/h2,4-5,11-12,16H,3,6-10,13-15H2,1H3
InChIKeyCBVUKHMVMNBFQP-UHFFFAOYSA-N
XLogP4.58
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-1-phenylcyclohexyl)piperidine?
The IUPAC name of 1-(2-methyl-1-phenylcyclohexyl)piperidine (CID 3017138) is 1-(2-methyl-1-phenylcyclohexyl)piperidine.
What is the SMILES notation for 1-(2-methyl-1-phenylcyclohexyl)piperidine?
The canonical SMILES for 1-(2-methyl-1-phenylcyclohexyl)piperidine is CC1CCCCC1(c1ccccc1)N1CCCCC1.
What is the InChIKey of 1-(2-methyl-1-phenylcyclohexyl)piperidine?
The InChIKey is CBVUKHMVMNBFQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N/c1-16-10-6-7-13-18(16,17-11-4-2-5-12-17)19-14-8-3-9-15-19/h2,4-5,11-12,16H,3,6-10,13-15H2,1H3.
What are the key properties of 1-(2-methyl-1-phenylcyclohexyl)piperidine?
1-(2-methyl-1-phenylcyclohexyl)piperidine has a molecular weight of 257.42 g/mol, XLogP of 4.58, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-1-phenylcyclohexyl)piperidine is sourced from PubChem (CID 3017138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).