N-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine

C14H23N — CID 43225135

IUPACN-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine
SMILESC1=CC2CC1CC2CNC1CCCCC1
InChIInChI=1S/C14H23N/c1-2-4-14(5-3-1)15-10-13-9-11-6-7-12(13)8-11/h6-7,11-15H,1-5,8-10H2
InChIKeyDRCIMUCCONNIPI-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.12
Rot. Bonds3

About N-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine

N-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine (PubChem CID 43225135) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine
PubChem CID43225135
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC NameN-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine
SMILESC1=CC2CC1CC2CNC1CCCCC1
InChIInChI=1S/C14H23N/c1-2-4-14(5-3-1)15-10-13-9-11-6-7-12(13)8-11/h6-7,11-15H,1-5,8-10H2
InChIKeyDRCIMUCCONNIPI-UHFFFAOYSA-N
XLogP3.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.12
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-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine?
The IUPAC name of N-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine (CID 43225135) is N-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine.
What is the SMILES notation for N-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine?
The canonical SMILES for N-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine is C1=CC2CC1CC2CNC1CCCCC1.
What is the InChIKey of N-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine?
The InChIKey is DRCIMUCCONNIPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-2-4-14(5-3-1)15-10-13-9-11-6-7-12(13)8-11/h6-7,11-15H,1-5,8-10H2.
What are the key properties of N-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine?
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine has a molecular weight of 205.34 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]hept-5-enylmethyl)cyclohexanamine is sourced from PubChem (CID 43225135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).