3-(3-methyltriazol-4-yl)oxypiperidine

C8H14N4O — CID 130486949

IUPAC3-(3-methyltriazol-4-yl)oxypiperidine
SMILESCn1nncc1OC1CCCNC1
InChIInChI=1S/C8H14N4O/c1-12-8(6-10-11-12)13-7-3-2-4-9-5-7/h6-7,9H,2-5H2,1H3
InChIKeyWEQFLHNABDRVJR-UHFFFAOYSA-N
MW182.23 g/mol
LogP-0.05
Rot. Bonds2

About 3-(3-methyltriazol-4-yl)oxypiperidine

3-(3-methyltriazol-4-yl)oxypiperidine (PubChem CID 130486949) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is 3-(3-methyltriazol-4-yl)oxypiperidine.

Molecular Properties

Compound Name3-(3-methyltriazol-4-yl)oxypiperidine
PubChem CID130486949
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC Name3-(3-methyltriazol-4-yl)oxypiperidine
SMILESCn1nncc1OC1CCCNC1
InChIInChI=1S/C8H14N4O/c1-12-8(6-10-11-12)13-7-3-2-4-9-5-7/h6-7,9H,2-5H2,1H3
InChIKeyWEQFLHNABDRVJR-UHFFFAOYSA-N
XLogP-0.05
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine
CID 66247592
1-methyl-3-piperidin-3-yloxyindazole
CID 84694858
4-[(3-methyltriazol-4-yl)oxymethyl]piperidine
CID 84667041
2-methoxy-6-[(3R)-piperidin-3-yl]oxypyridine
CID 96644678
2-methyl-5-piperidin-3-yloxypyridine
CID 18712955
5-methyl-2-[(3S)-piperidin-3-yl]oxypyridine
CID 66246612
5-piperidin-3-yloxypyrimidin-2-amine
CID 117230818
5-bromo-3-methoxy-2-piperidin-3-yloxypyrazine
CID 131278584
2-[(3R)-piperidin-3-yl]oxypyrazine
CID 71637336
4,6-dimethyl-2-piperidin-3-yloxypyrimidine;hydrochloride
CID 71638406
(3R)-3-(1-methylpyrazol-4-yl)oxypiperidine;2,2,2-trifluoroacetic acid
CID 170306643
(3R)-3-phenoxypiperidine
CID 42553363

Frequently Asked Questions

What is the IUPAC name of 3-(3-methyltriazol-4-yl)oxypiperidine?
The IUPAC name of 3-(3-methyltriazol-4-yl)oxypiperidine (CID 130486949) is 3-(3-methyltriazol-4-yl)oxypiperidine.
What is the SMILES notation for 3-(3-methyltriazol-4-yl)oxypiperidine?
The canonical SMILES for 3-(3-methyltriazol-4-yl)oxypiperidine is Cn1nncc1OC1CCCNC1.
What is the InChIKey of 3-(3-methyltriazol-4-yl)oxypiperidine?
The InChIKey is WEQFLHNABDRVJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c1-12-8(6-10-11-12)13-7-3-2-4-9-5-7/h6-7,9H,2-5H2,1H3.
What are the key properties of 3-(3-methyltriazol-4-yl)oxypiperidine?
3-(3-methyltriazol-4-yl)oxypiperidine has a molecular weight of 182.23 g/mol, XLogP of -0.05, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methyltriazol-4-yl)oxypiperidine is sourced from PubChem (CID 130486949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).