2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine

C16H25N3 — CID 79545513

IUPAC2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine
SMILESc1ccc(CNC2CCCC2C2CCCCN2)nc1
InChIInChI=1S/C16H25N3/c1-3-10-17-13(6-1)12-19-16-9-5-7-14(16)15-8-2-4-11-18-15/h1,3,6,10,14-16,18-19H,2,4-5,7-9,11-12H2
InChIKeyPOZJEZOBHABRFM-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.48
Rot. Bonds4

About 2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine

2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine (PubChem CID 79545513) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is 2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine
PubChem CID79545513
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine
SMILESc1ccc(CNC2CCCC2C2CCCCN2)nc1
InChIInChI=1S/C16H25N3/c1-3-10-17-13(6-1)12-19-16-9-5-7-14(16)15-8-2-4-11-18-15/h1,3,6,10,14-16,18-19H,2,4-5,7-9,11-12H2
InChIKeyPOZJEZOBHABRFM-UHFFFAOYSA-N
XLogP2.48
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine?
The IUPAC name of 2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine (CID 79545513) is 2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for 2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for 2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine is c1ccc(CNC2CCCC2C2CCCCN2)nc1.
What is the InChIKey of 2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine?
The InChIKey is POZJEZOBHABRFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-3-10-17-13(6-1)12-19-16-9-5-7-14(16)15-8-2-4-11-18-15/h1,3,6,10,14-16,18-19H,2,4-5,7-9,11-12H2.
What are the key properties of 2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine?
2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine has a molecular weight of 259.40 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-2-yl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 79545513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).