8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol

C13H23NO — CID 63770465

IUPAC8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol
SMILESOC1CC2CCC(C1)N2CC1CCCC1
InChIInChI=1S/C13H23NO/c15-13-7-11-5-6-12(8-13)14(11)9-10-3-1-2-4-10/h10-13,15H,1-9H2
InChIKeyAASFCMMDTZVNFT-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.16
Rot. Bonds2

About 8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol

8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol (PubChem CID 63770465) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol.

Molecular Properties

Compound Name8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol
PubChem CID63770465
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol
SMILESOC1CC2CCC(C1)N2CC1CCCC1
InChIInChI=1S/C13H23NO/c15-13-7-11-5-6-12(8-13)14(11)9-10-3-1-2-4-10/h10-13,15H,1-9H2
InChIKeyAASFCMMDTZVNFT-UHFFFAOYSA-N
XLogP2.16
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol?
The IUPAC name of 8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol (CID 63770465) is 8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol.
What is the SMILES notation for 8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol?
The canonical SMILES for 8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol is OC1CC2CCC(C1)N2CC1CCCC1.
What is the InChIKey of 8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol?
The InChIKey is AASFCMMDTZVNFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c15-13-7-11-5-6-12(8-13)14(11)9-10-3-1-2-4-10/h10-13,15H,1-9H2.
What are the key properties of 8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol?
8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol has a molecular weight of 209.33 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol is sourced from PubChem (CID 63770465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).