N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine

C15H21N — CID 14584

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IUPACN-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine
SMILESCCNC1C2CCC(C2)C1c1ccccc1
InChIInChI=1S/C15H21N/c1-2-16-15-13-9-8-12(10-13)14(15)11-6-4-3-5-7-11/h3-7,12-16H,2,8-10H2,1H3
InChIKeyIKFBPFGUINLYQI-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.18
Rot. Bonds3

About N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine

N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine (PubChem CID 14584) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine.

Molecular Properties

Compound NameN-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine
PubChem CID14584
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC NameN-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine
SMILESCCNC1C2CCC(C2)C1c1ccccc1
InChIInChI=1S/C15H21N/c1-2-16-15-13-9-8-12(10-13)14(15)11-6-4-3-5-7-11/h3-7,12-16H,2,8-10H2,1H3
InChIKeyIKFBPFGUINLYQI-UHFFFAOYSA-N
XLogP3.18
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine?
The IUPAC name of N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine (CID 14584) is N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine.
What is the SMILES notation for N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine?
The canonical SMILES for N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine is CCNC1C2CCC(C2)C1c1ccccc1.
What is the InChIKey of N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine?
The InChIKey is IKFBPFGUINLYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-2-16-15-13-9-8-12(10-13)14(15)11-6-4-3-5-7-11/h3-7,12-16H,2,8-10H2,1H3.
What are the key properties of N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine?
N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine has a molecular weight of 215.34 g/mol, XLogP of 3.18, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-phenylbicyclo[2.2.1]heptan-2-amine is sourced from PubChem (CID 14584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).