4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine

C10H18N4O — CID 106939218

IUPAC4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine
SMILESCC1CCNCC1OCc1nncn1C
InChIInChI=1S/C10H18N4O/c1-8-3-4-11-5-9(8)15-6-10-13-12-7-14(10)2/h7-9,11H,3-6H2,1-2H3
InChIKeyYWQRQHYLXRLTPE-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.33
Rot. Bonds3

About 4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine

4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine (PubChem CID 106939218) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine.

Molecular Properties

Compound Name4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine
PubChem CID106939218
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine
SMILESCC1CCNCC1OCc1nncn1C
InChIInChI=1S/C10H18N4O/c1-8-3-4-11-5-9(8)15-6-10-13-12-7-14(10)2/h7-9,11H,3-6H2,1-2H3
InChIKeyYWQRQHYLXRLTPE-UHFFFAOYSA-N
XLogP0.33
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-3-[[(3S)-pyrrolidin-3-yl]methyl]-1,2,4-triazole
CID 97011669
3-[(4-methylpiperidin-3-yl)oxymethyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
CID 107078221
4-[(4-methylpiperidin-3-yl)oxymethyl]pyridine
CID 102954056
4-methyl-3-phenylmethoxypiperidine
CID 102954119
4-[2-(4-methyl-1,2,4-triazol-3-yl)ethoxy]piperidine
CID 63875829
2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole
CID 102954373
3-[(1-butan-2-ylpyrazol-3-yl)methoxy]-4-methylpiperidine
CID 102954086
3-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]pyridine
CID 102954306
3-[(4-methylpiperidin-3-yl)oxymethyl]-1,2,5-thiadiazole
CID 130942600
4-methyl-3-[[4-(trifluoromethoxy)phenyl]methoxy]piperidine
CID 102954321
4-methyl-3-(thiophen-2-ylmethoxy)piperidine
CID 102954007
4-methyl-3-[(3R)-pyrrolidin-3-yl]-1,2,4-triazole
CID 94917936

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine?
The IUPAC name of 4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine (CID 106939218) is 4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine.
What is the SMILES notation for 4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine?
The canonical SMILES for 4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine is CC1CCNCC1OCc1nncn1C.
What is the InChIKey of 4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine?
The InChIKey is YWQRQHYLXRLTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-8-3-4-11-5-9(8)15-6-10-13-12-7-14(10)2/h7-9,11H,3-6H2,1-2H3.
What are the key properties of 4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine?
4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine has a molecular weight of 210.28 g/mol, XLogP of 0.33, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine is sourced from PubChem (CID 106939218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).