5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine

C14H24N4 — CID 72928341

IUPAC5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine
SMILESCc1cnc(NCC(C)(C)N2CCCCC2)nc1
InChIInChI=1S/C14H24N4/c1-12-9-15-13(16-10-12)17-11-14(2,3)18-7-5-4-6-8-18/h9-10H,4-8,11H2,1-3H3,(H,15,16,17)
InChIKeyJNKHTSFQTGFBRR-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.46
Rot. Bonds4

About 5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine

5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine (PubChem CID 72928341) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine
PubChem CID72928341
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine
SMILESCc1cnc(NCC(C)(C)N2CCCCC2)nc1
InChIInChI=1S/C14H24N4/c1-12-9-15-13(16-10-12)17-11-14(2,3)18-7-5-4-6-8-18/h9-10H,4-8,11H2,1-3H3,(H,15,16,17)
InChIKeyJNKHTSFQTGFBRR-UHFFFAOYSA-N
XLogP2.46
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine?
The IUPAC name of 5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine (CID 72928341) is 5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine.
What is the SMILES notation for 5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine?
The canonical SMILES for 5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine is Cc1cnc(NCC(C)(C)N2CCCCC2)nc1.
What is the InChIKey of 5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine?
The InChIKey is JNKHTSFQTGFBRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-12-9-15-13(16-10-12)17-11-14(2,3)18-7-5-4-6-8-18/h9-10H,4-8,11H2,1-3H3,(H,15,16,17).
What are the key properties of 5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine?
5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine has a molecular weight of 248.37 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine is sourced from PubChem (CID 72928341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).