N-(2-phenylethyl)cyclohexen-1-amine

C14H19N — CID 14892746

IUPACN-(2-phenylethyl)cyclohexen-1-amine
SMILESC1=C(NCCc2ccccc2)CCCC1
InChIInChI=1S/C14H19N/c1-3-7-13(8-4-1)11-12-15-14-9-5-2-6-10-14/h1,3-4,7-9,15H,2,5-6,10-12H2
InChIKeyQELIOYIBYFPBIJ-UHFFFAOYSA-N
MW201.31 g/mol
LogP3.28
Rot. Bonds4

About N-(2-phenylethyl)cyclohexen-1-amine

N-(2-phenylethyl)cyclohexen-1-amine (PubChem CID 14892746) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is N-(2-phenylethyl)cyclohexen-1-amine.

Molecular Properties

Compound NameN-(2-phenylethyl)cyclohexen-1-amine
PubChem CID14892746
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC NameN-(2-phenylethyl)cyclohexen-1-amine
SMILESC1=C(NCCc2ccccc2)CCCC1
InChIInChI=1S/C14H19N/c1-3-7-13(8-4-1)11-12-15-14-9-5-2-6-10-14/h1,3-4,7-9,15H,2,5-6,10-12H2
InChIKeyQELIOYIBYFPBIJ-UHFFFAOYSA-N
XLogP3.28
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)cyclohexen-1-amine?
The IUPAC name of N-(2-phenylethyl)cyclohexen-1-amine (CID 14892746) is N-(2-phenylethyl)cyclohexen-1-amine.
What is the SMILES notation for N-(2-phenylethyl)cyclohexen-1-amine?
The canonical SMILES for N-(2-phenylethyl)cyclohexen-1-amine is C1=C(NCCc2ccccc2)CCCC1.
What is the InChIKey of N-(2-phenylethyl)cyclohexen-1-amine?
The InChIKey is QELIOYIBYFPBIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-3-7-13(8-4-1)11-12-15-14-9-5-2-6-10-14/h1,3-4,7-9,15H,2,5-6,10-12H2.
What are the key properties of N-(2-phenylethyl)cyclohexen-1-amine?
N-(2-phenylethyl)cyclohexen-1-amine has a molecular weight of 201.31 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)cyclohexen-1-amine is sourced from PubChem (CID 14892746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).