6-piperidin-1-ylpyrimidine-2,4-diamine

C9H15N5 — CID 606255

IUPAC6-piperidin-1-ylpyrimidine-2,4-diamine
SMILESNc1cc(N2CCCCC2)nc(N)n1
InChIInChI=1S/C9H15N5/c10-7-6-8(13-9(11)12-7)14-4-2-1-3-5-14/h6H,1-5H2,(H4,10,11,12,13)
InChIKeyIPFIEHIRBSTAKA-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.63
Rot. Bonds1

About 6-piperidin-1-ylpyrimidine-2,4-diamine

6-piperidin-1-ylpyrimidine-2,4-diamine (PubChem CID 606255) has the molecular formula C9H15N5 and a molecular weight of 193.25 g/mol. Its IUPAC name is 6-piperidin-1-ylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-piperidin-1-ylpyrimidine-2,4-diamine
PubChem CID606255
Molecular FormulaC9H15N5
Molecular Weight193.25 g/mol
Exact Mass193.13
IUPAC Name6-piperidin-1-ylpyrimidine-2,4-diamine
SMILESNc1cc(N2CCCCC2)nc(N)n1
InChIInChI=1S/C9H15N5/c10-7-6-8(13-9(11)12-7)14-4-2-1-3-5-14/h6H,1-5H2,(H4,10,11,12,13)
InChIKeyIPFIEHIRBSTAKA-UHFFFAOYSA-N
XLogP0.63
TPSA81.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-piperidin-1-ylpyrimidine-2,4-diamine?
The IUPAC name of 6-piperidin-1-ylpyrimidine-2,4-diamine (CID 606255) is 6-piperidin-1-ylpyrimidine-2,4-diamine.
What is the SMILES notation for 6-piperidin-1-ylpyrimidine-2,4-diamine?
The canonical SMILES for 6-piperidin-1-ylpyrimidine-2,4-diamine is Nc1cc(N2CCCCC2)nc(N)n1.
What is the InChIKey of 6-piperidin-1-ylpyrimidine-2,4-diamine?
The InChIKey is IPFIEHIRBSTAKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5/c10-7-6-8(13-9(11)12-7)14-4-2-1-3-5-14/h6H,1-5H2,(H4,10,11,12,13).
What are the key properties of 6-piperidin-1-ylpyrimidine-2,4-diamine?
6-piperidin-1-ylpyrimidine-2,4-diamine has a molecular weight of 193.25 g/mol, XLogP of 0.63, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperidin-1-ylpyrimidine-2,4-diamine is sourced from PubChem (CID 606255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).