6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine

C10H17N5 — CID 115025325

IUPAC6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine
SMILESCc1cc(N)nc(NC2CCNCC2)n1
InChIInChI=1S/C10H17N5/c1-7-6-9(11)15-10(13-7)14-8-2-4-12-5-3-8/h6,8,12H,2-5H2,1H3,(H3,11,13,14,15)
InChIKeyQNTIHPNELIFWOR-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.53
Rot. Bonds2

About 6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine

6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine (PubChem CID 115025325) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is 6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine
PubChem CID115025325
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC Name6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine
SMILESCc1cc(N)nc(NC2CCNCC2)n1
InChIInChI=1S/C10H17N5/c1-7-6-9(11)15-10(13-7)14-8-2-4-12-5-3-8/h6,8,12H,2-5H2,1H3,(H3,11,13,14,15)
InChIKeyQNTIHPNELIFWOR-UHFFFAOYSA-N
XLogP0.53
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine?
The IUPAC name of 6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine (CID 115025325) is 6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine.
What is the SMILES notation for 6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine?
The canonical SMILES for 6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine is Cc1cc(N)nc(NC2CCNCC2)n1.
What is the InChIKey of 6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine?
The InChIKey is QNTIHPNELIFWOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5/c1-7-6-9(11)15-10(13-7)14-8-2-4-12-5-3-8/h6,8,12H,2-5H2,1H3,(H3,11,13,14,15).
What are the key properties of 6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine?
6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine has a molecular weight of 207.28 g/mol, XLogP of 0.53, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine is sourced from PubChem (CID 115025325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).