4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine

C11H17N3O2 — CID 62349161

IUPAC4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine
SMILESCOc1ccnc(OCC2CCCCN2)n1
InChIInChI=1S/C11H17N3O2/c1-15-10-5-7-13-11(14-10)16-8-9-4-2-3-6-12-9/h5,7,9,12H,2-4,6,8H2,1H3
InChIKeyVOBGMXAPOCAQDA-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.01
Rot. Bonds4

About 4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine

4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine (PubChem CID 62349161) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine.

Molecular Properties

Compound Name4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine
PubChem CID62349161
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine
SMILESCOc1ccnc(OCC2CCCCN2)n1
InChIInChI=1S/C11H17N3O2/c1-15-10-5-7-13-11(14-10)16-8-9-4-2-3-6-12-9/h5,7,9,12H,2-4,6,8H2,1H3
InChIKeyVOBGMXAPOCAQDA-UHFFFAOYSA-N
XLogP1.01
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine?
The IUPAC name of 4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine (CID 62349161) is 4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine.
What is the SMILES notation for 4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine?
The canonical SMILES for 4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine is COc1ccnc(OCC2CCCCN2)n1.
What is the InChIKey of 4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine?
The InChIKey is VOBGMXAPOCAQDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-15-10-5-7-13-11(14-10)16-8-9-4-2-3-6-12-9/h5,7,9,12H,2-4,6,8H2,1H3.
What are the key properties of 4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine?
4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine has a molecular weight of 223.28 g/mol, XLogP of 1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(piperidin-2-ylmethoxy)pyrimidine is sourced from PubChem (CID 62349161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).