N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine

C15H24N4 — CID 112868596

IUPACN-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine
SMILESCc1nc(NC2CCCC2)cc(N2CCCCC2)n1
InChIInChI=1S/C15H24N4/c1-12-16-14(18-13-7-3-4-8-13)11-15(17-12)19-9-5-2-6-10-19/h11,13H,2-10H2,1H3,(H,16,17,18)
InChIKeyAOIJAVIPWIOHSM-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.13
Rot. Bonds3

About N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine

N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine (PubChem CID 112868596) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine
PubChem CID112868596
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC NameN-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine
SMILESCc1nc(NC2CCCC2)cc(N2CCCCC2)n1
InChIInChI=1S/C15H24N4/c1-12-16-14(18-13-7-3-4-8-13)11-15(17-12)19-9-5-2-6-10-19/h11,13H,2-10H2,1H3,(H,16,17,18)
InChIKeyAOIJAVIPWIOHSM-UHFFFAOYSA-N
XLogP3.13
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine?
The IUPAC name of N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine (CID 112868596) is N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine.
What is the SMILES notation for N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine?
The canonical SMILES for N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine is Cc1nc(NC2CCCC2)cc(N2CCCCC2)n1.
What is the InChIKey of N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine?
The InChIKey is AOIJAVIPWIOHSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-12-16-14(18-13-7-3-4-8-13)11-15(17-12)19-9-5-2-6-10-19/h11,13H,2-10H2,1H3,(H,16,17,18).
What are the key properties of N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine?
N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine has a molecular weight of 260.38 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine is sourced from PubChem (CID 112868596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).