3-piperidin-4-yl-5-propyl-1,2,4-triazine

C11H18N4 — CID 105459553

IUPAC3-piperidin-4-yl-5-propyl-1,2,4-triazine
SMILESCCCc1cnnc(C2CCNCC2)n1
InChIInChI=1S/C11H18N4/c1-2-3-10-8-13-15-11(14-10)9-4-6-12-7-5-9/h8-9,12H,2-7H2,1H3
InChIKeyVDROPGLWNGMEAR-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.29
Rot. Bonds3

About 3-piperidin-4-yl-5-propyl-1,2,4-triazine

3-piperidin-4-yl-5-propyl-1,2,4-triazine (PubChem CID 105459553) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 3-piperidin-4-yl-5-propyl-1,2,4-triazine.

Molecular Properties

Compound Name3-piperidin-4-yl-5-propyl-1,2,4-triazine
PubChem CID105459553
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name3-piperidin-4-yl-5-propyl-1,2,4-triazine
SMILESCCCc1cnnc(C2CCNCC2)n1
InChIInChI=1S/C11H18N4/c1-2-3-10-8-13-15-11(14-10)9-4-6-12-7-5-9/h8-9,12H,2-7H2,1H3
InChIKeyVDROPGLWNGMEAR-UHFFFAOYSA-N
XLogP1.29
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-3-pyrrolidin-3-yl-1,2,4-triazine
CID 105437732
5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine
CID 105456701
5-ethyl-3-(piperidin-4-ylmethyl)-1,2,4-triazine
CID 105459668
4-cyclopropyl-6-ethyl-2-piperidin-4-ylpyrimidine
CID 55206429
5-ethyl-2-piperidin-4-ylpyrimidine
CID 83697990
3-cyclobutyl-5-piperazin-1-yl-1,2,4-triazine
CID 116824028
4-[(5-propyl-1H-imidazol-2-yl)methyl]piperidine
CID 114998934
2,4-dimethyl-6-piperidin-4-yl-1,3,5-triazine
CID 82468969
N-(2-piperidin-4-ylethyl)-6-propylpyridazin-3-amine
CID 116972215
methane;5-methyl-2-piperidin-4-ylpyrimidine
CID 157310053
5-piperazin-1-yl-3-propyl-1,2,4-triazine
CID 116823993
4-chloro-2-cyclooctyl-6-propylpyrimidine
CID 80602535

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yl-5-propyl-1,2,4-triazine?
The IUPAC name of 3-piperidin-4-yl-5-propyl-1,2,4-triazine (CID 105459553) is 3-piperidin-4-yl-5-propyl-1,2,4-triazine.
What is the SMILES notation for 3-piperidin-4-yl-5-propyl-1,2,4-triazine?
The canonical SMILES for 3-piperidin-4-yl-5-propyl-1,2,4-triazine is CCCc1cnnc(C2CCNCC2)n1.
What is the InChIKey of 3-piperidin-4-yl-5-propyl-1,2,4-triazine?
The InChIKey is VDROPGLWNGMEAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-2-3-10-8-13-15-11(14-10)9-4-6-12-7-5-9/h8-9,12H,2-7H2,1H3.
What are the key properties of 3-piperidin-4-yl-5-propyl-1,2,4-triazine?
3-piperidin-4-yl-5-propyl-1,2,4-triazine has a molecular weight of 206.29 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yl-5-propyl-1,2,4-triazine is sourced from PubChem (CID 105459553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).