(2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine

C13H24N2 — CID 115026144

IUPAC(2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine
SMILESNCC1CC2CCC(N2)C1C1CCCC1
InChIInChI=1S/C13H24N2/c14-8-10-7-11-5-6-12(15-11)13(10)9-3-1-2-4-9/h9-13,15H,1-8,14H2
InChIKeyPPQPVRZUBLUBEJ-UHFFFAOYSA-N
MW208.35 g/mol
LogP1.89
Rot. Bonds2

About (2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine

(2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine (PubChem CID 115026144) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is (2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine.

Molecular Properties

Compound Name(2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine
PubChem CID115026144
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name(2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine
SMILESNCC1CC2CCC(N2)C1C1CCCC1
InChIInChI=1S/C13H24N2/c14-8-10-7-11-5-6-12(15-11)13(10)9-3-1-2-4-9/h9-13,15H,1-8,14H2
InChIKeyPPQPVRZUBLUBEJ-UHFFFAOYSA-N
XLogP1.89
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine?
The IUPAC name of (2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine (CID 115026144) is (2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine.
What is the SMILES notation for (2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine?
The canonical SMILES for (2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine is NCC1CC2CCC(N2)C1C1CCCC1.
What is the InChIKey of (2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine?
The InChIKey is PPQPVRZUBLUBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c14-8-10-7-11-5-6-12(15-11)13(10)9-3-1-2-4-9/h9-13,15H,1-8,14H2.
What are the key properties of (2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine?
(2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine has a molecular weight of 208.35 g/mol, XLogP of 1.89, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopentyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine is sourced from PubChem (CID 115026144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).