4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine

C13H21N5 — CID 55251303

IUPAC4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
SMILESNc1nc(C2CCCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C13H21N5/c14-12-15-11(10-6-2-3-7-10)16-13(17-12)18-8-4-1-5-9-18/h10H,1-9H2,(H2,14,15,16,17)
InChIKeySOBAPMJGVLSGDB-UHFFFAOYSA-N
MW247.35 g/mol
LogP2.10
Rot. Bonds2

About 4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine

4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine (PubChem CID 55251303) has the molecular formula C13H21N5 and a molecular weight of 247.35 g/mol. Its IUPAC name is 4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
PubChem CID55251303
Molecular FormulaC13H21N5
Molecular Weight247.35 g/mol
Exact Mass247.18
IUPAC Name4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
SMILESNc1nc(C2CCCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C13H21N5/c14-12-15-11(10-6-2-3-7-10)16-13(17-12)18-8-4-1-5-9-18/h10H,1-9H2,(H2,14,15,16,17)
InChIKeySOBAPMJGVLSGDB-UHFFFAOYSA-N
XLogP2.10
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.35
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine (CID 55251303) is 4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine is Nc1nc(C2CCCC2)nc(N2CCCCC2)n1.
What is the InChIKey of 4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The InChIKey is SOBAPMJGVLSGDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5/c14-12-15-11(10-6-2-3-7-10)16-13(17-12)18-8-4-1-5-9-18/h10H,1-9H2,(H2,14,15,16,17).
What are the key properties of 4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine?
4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine has a molecular weight of 247.35 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-6-piperidin-1-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 55251303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).