5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine

C11H17N3O — CID 117231656

IUPAC5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine
SMILESCOc1cnc(CC2CCCCN2)nc1
InChIInChI=1S/C11H17N3O/c1-15-10-7-13-11(14-8-10)6-9-4-2-3-5-12-9/h7-9,12H,2-6H2,1H3
InChIKeyBIQAKTICJUHBLD-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.17
Rot. Bonds3

About 5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine

5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine (PubChem CID 117231656) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine.

Molecular Properties

Compound Name5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine
PubChem CID117231656
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine
SMILESCOc1cnc(CC2CCCCN2)nc1
InChIInChI=1S/C11H17N3O/c1-15-10-7-13-11(14-8-10)6-9-4-2-3-5-12-9/h7-9,12H,2-6H2,1H3
InChIKeyBIQAKTICJUHBLD-UHFFFAOYSA-N
XLogP1.17
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethoxy-2-(piperidin-2-ylmethyl)pyrimidine
CID 117231619
5-[(2-methylpropan-2-yl)oxy]-2-(pyrrolidin-2-ylmethyl)pyrimidine
CID 117231618
5-methoxy-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyrimidin-2-amine
CID 104973513
5-methoxy-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-2-amine
CID 104973111
2-[(2,3,5-trimethoxyphenyl)methyl]piperidine
CID 117417667
2-[(2,4-dimethoxyphenyl)methyl]piperidine
CID 62800646
6-methoxy-1-(piperidin-2-ylmethyl)isoquinoline
CID 116995390
2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 84735082
4-tert-butyl-6-methoxy-2-(piperidin-2-ylmethyl)pyrimidine
CID 82666688
1-[3-methoxy-5-(piperidin-2-ylmethyl)phenyl]-N,N-dimethylmethanamine
CID 117411127
(2S)-2-[(4-methoxyphenyl)methoxymethyl]piperidine
CID 86324715
2-[3-(4-methoxyphenyl)propyl]piperidine
CID 65446310

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine?
The IUPAC name of 5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine (CID 117231656) is 5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine.
What is the SMILES notation for 5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine?
The canonical SMILES for 5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine is COc1cnc(CC2CCCCN2)nc1.
What is the InChIKey of 5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine?
The InChIKey is BIQAKTICJUHBLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-15-10-7-13-11(14-8-10)6-9-4-2-3-5-12-9/h7-9,12H,2-6H2,1H3.
What are the key properties of 5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine?
5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine has a molecular weight of 207.28 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine is sourced from PubChem (CID 117231656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).