6-methoxy-N-piperidin-4-ylpyrimidin-4-amine

C10H16N4O — CID 66319414

IUPAC6-methoxy-N-piperidin-4-ylpyrimidin-4-amine
SMILESCOc1cc(NC2CCNCC2)ncn1
InChIInChI=1S/C10H16N4O/c1-15-10-6-9(12-7-13-10)14-8-2-4-11-5-3-8/h6-8,11H,2-5H2,1H3,(H,12,13,14)
InChIKeyQOCNZAYZXGCYFE-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.65
Rot. Bonds3

About 6-methoxy-N-piperidin-4-ylpyrimidin-4-amine

6-methoxy-N-piperidin-4-ylpyrimidin-4-amine (PubChem CID 66319414) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 6-methoxy-N-piperidin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-N-piperidin-4-ylpyrimidin-4-amine
PubChem CID66319414
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name6-methoxy-N-piperidin-4-ylpyrimidin-4-amine
SMILESCOc1cc(NC2CCNCC2)ncn1
InChIInChI=1S/C10H16N4O/c1-15-10-6-9(12-7-13-10)14-8-2-4-11-5-3-8/h6-8,11H,2-5H2,1H3,(H,12,13,14)
InChIKeyQOCNZAYZXGCYFE-UHFFFAOYSA-N
XLogP0.65
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-piperidin-4-ylpyrimidin-4-amine?
The IUPAC name of 6-methoxy-N-piperidin-4-ylpyrimidin-4-amine (CID 66319414) is 6-methoxy-N-piperidin-4-ylpyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-N-piperidin-4-ylpyrimidin-4-amine?
The canonical SMILES for 6-methoxy-N-piperidin-4-ylpyrimidin-4-amine is COc1cc(NC2CCNCC2)ncn1.
What is the InChIKey of 6-methoxy-N-piperidin-4-ylpyrimidin-4-amine?
The InChIKey is QOCNZAYZXGCYFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-15-10-6-9(12-7-13-10)14-8-2-4-11-5-3-8/h6-8,11H,2-5H2,1H3,(H,12,13,14).
What are the key properties of 6-methoxy-N-piperidin-4-ylpyrimidin-4-amine?
6-methoxy-N-piperidin-4-ylpyrimidin-4-amine has a molecular weight of 208.26 g/mol, XLogP of 0.65, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-piperidin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 66319414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).