4-methoxy-N-piperidin-4-ylpyrimidin-2-amine

C10H16N4O — CID 43607806

IUPAC4-methoxy-N-piperidin-4-ylpyrimidin-2-amine
SMILESCOc1ccnc(NC2CCNCC2)n1
InChIInChI=1S/C10H16N4O/c1-15-9-4-7-12-10(14-9)13-8-2-5-11-6-3-8/h4,7-8,11H,2-3,5-6H2,1H3,(H,12,13,14)
InChIKeySYQUXJKDFTUOPM-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.65
Rot. Bonds3

About 4-methoxy-N-piperidin-4-ylpyrimidin-2-amine

4-methoxy-N-piperidin-4-ylpyrimidin-2-amine (PubChem CID 43607806) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 4-methoxy-N-piperidin-4-ylpyrimidin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-piperidin-4-ylpyrimidin-2-amine
PubChem CID43607806
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name4-methoxy-N-piperidin-4-ylpyrimidin-2-amine
SMILESCOc1ccnc(NC2CCNCC2)n1
InChIInChI=1S/C10H16N4O/c1-15-9-4-7-12-10(14-9)13-8-2-5-11-6-3-8/h4,7-8,11H,2-3,5-6H2,1H3,(H,12,13,14)
InChIKeySYQUXJKDFTUOPM-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 4-methoxy-N-piperidin-4-ylpyrimidin-2-amine?
The IUPAC name of 4-methoxy-N-piperidin-4-ylpyrimidin-2-amine (CID 43607806) is 4-methoxy-N-piperidin-4-ylpyrimidin-2-amine.
What is the SMILES notation for 4-methoxy-N-piperidin-4-ylpyrimidin-2-amine?
The canonical SMILES for 4-methoxy-N-piperidin-4-ylpyrimidin-2-amine is COc1ccnc(NC2CCNCC2)n1.
What is the InChIKey of 4-methoxy-N-piperidin-4-ylpyrimidin-2-amine?
The InChIKey is SYQUXJKDFTUOPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-15-9-4-7-12-10(14-9)13-8-2-5-11-6-3-8/h4,7-8,11H,2-3,5-6H2,1H3,(H,12,13,14).
What are the key properties of 4-methoxy-N-piperidin-4-ylpyrimidin-2-amine?
4-methoxy-N-piperidin-4-ylpyrimidin-2-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 4-methoxy-N-piperidin-4-ylpyrimidin-2-amine is sourced from PubChem (CID 43607806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).