2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol

C11H16N2O — CID 176715587

IUPAC2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol
SMILESNCC1C(O)CCC1c1cccnc1
InChIInChI=1S/C11H16N2O/c12-6-10-9(3-4-11(10)14)8-2-1-5-13-7-8/h1-2,5,7,9-11,14H,3-4,6,12H2
InChIKeyWHLIXZPKXHDXBL-UHFFFAOYSA-N
MW192.26 g/mol
LogP0.89
Rot. Bonds2

About 2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol

2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol (PubChem CID 176715587) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol.

Molecular Properties

Compound Name2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol
PubChem CID176715587
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol
SMILESNCC1C(O)CCC1c1cccnc1
InChIInChI=1S/C11H16N2O/c12-6-10-9(3-4-11(10)14)8-2-1-5-13-7-8/h1-2,5,7,9-11,14H,3-4,6,12H2
InChIKeyWHLIXZPKXHDXBL-UHFFFAOYSA-N
XLogP0.89
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol?
The IUPAC name of 2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol (CID 176715587) is 2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol.
What is the SMILES notation for 2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol?
The canonical SMILES for 2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol is NCC1C(O)CCC1c1cccnc1.
What is the InChIKey of 2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol?
The InChIKey is WHLIXZPKXHDXBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c12-6-10-9(3-4-11(10)14)8-2-1-5-13-7-8/h1-2,5,7,9-11,14H,3-4,6,12H2.
What are the key properties of 2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol?
2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol has a molecular weight of 192.26 g/mol, XLogP of 0.89, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol is sourced from PubChem (CID 176715587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).