2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine

C15H24N4O — CID 102971626

IUPAC2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine
SMILESCNc1nc(C2CC2)nc(N2CCCC(OC)C2)c1C
InChIInChI=1S/C15H24N4O/c1-10-13(16-2)17-14(11-6-7-11)18-15(10)19-8-4-5-12(9-19)20-3/h11-12H,4-9H2,1-3H3,(H,16,17,18)
InChIKeyKLKFJNLKWNXYSY-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.32
Rot. Bonds4

About 2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine

2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine (PubChem CID 102971626) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine
PubChem CID102971626
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine
SMILESCNc1nc(C2CC2)nc(N2CCCC(OC)C2)c1C
InChIInChI=1S/C15H24N4O/c1-10-13(16-2)17-14(11-6-7-11)18-15(10)19-8-4-5-12(9-19)20-3/h11-12H,4-9H2,1-3H3,(H,16,17,18)
InChIKeyKLKFJNLKWNXYSY-UHFFFAOYSA-N
XLogP2.32
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine (CID 102971626) is 2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine is CNc1nc(C2CC2)nc(N2CCCC(OC)C2)c1C.
What is the InChIKey of 2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine?
The InChIKey is KLKFJNLKWNXYSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-10-13(16-2)17-14(11-6-7-11)18-15(10)19-8-4-5-12(9-19)20-3/h11-12H,4-9H2,1-3H3,(H,16,17,18).
What are the key properties of 2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine?
2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine has a molecular weight of 276.38 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-(3-methoxypiperidin-1-yl)-N,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 102971626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).