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

C11H16N4 — CID 105456701

IUPAC5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine
SMILESc1nnc(C2CCNCC2)nc1C1CC1
InChIInChI=1S/C11H16N4/c1-2-8(1)10-7-13-15-11(14-10)9-3-5-12-6-4-9/h7-9,12H,1-6H2
InChIKeyGTDMQTBUOXYEQI-UHFFFAOYSA-N
MW204.28 g/mol
LogP1.22
Rot. Bonds2

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

5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine (PubChem CID 105456701) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is 5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine.

Molecular Properties

Compound Name5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine
PubChem CID105456701
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC Name5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine
SMILESc1nnc(C2CCNCC2)nc1C1CC1
InChIInChI=1S/C11H16N4/c1-2-8(1)10-7-13-15-11(14-10)9-3-5-12-6-4-9/h7-9,12H,1-6H2
InChIKeyGTDMQTBUOXYEQI-UHFFFAOYSA-N
XLogP1.22
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-piperidin-4-yl-5-propyl-1,2,4-triazine
CID 105459553
5-ethyl-3-pyrrolidin-3-yl-1,2,4-triazine
CID 105437732
4-cyclopropyl-6-ethyl-2-piperidin-4-ylpyrimidine
CID 55206429
3-cyclobutyl-5-piperazin-1-yl-1,2,4-triazine
CID 116824028
3-piperidin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyrazine
CID 83832289
6-piperidin-4-ylpyridazin-3-amine
CID 117105175
N-methyl-6-piperidin-4-ylpyrazin-2-amine
CID 66509252
4-methyl-6-(oxan-4-yl)-2-piperidin-4-ylpyrimidine
CID 116893458
N-methyl-6-piperidin-4-ylpyrazin-2-amine;dihydrochloride
CID 71298949
methane;5-methyl-2-piperidin-4-ylpyrimidine
CID 157310053
2,4-dimethyl-6-piperidin-4-yl-1,3,5-triazine
CID 82468969
1-(5-cyclopropyl-1,2,4-triazin-3-yl)-N-methylmethanamine
CID 105432481

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine?
The IUPAC name of 5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine (CID 105456701) is 5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine.
What is the SMILES notation for 5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine?
The canonical SMILES for 5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine is c1nnc(C2CCNCC2)nc1C1CC1.
What is the InChIKey of 5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine?
The InChIKey is GTDMQTBUOXYEQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-2-8(1)10-7-13-15-11(14-10)9-3-5-12-6-4-9/h7-9,12H,1-6H2.
What are the key properties of 5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine?
5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine has a molecular weight of 204.28 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-3-piperidin-4-yl-1,2,4-triazine is sourced from PubChem (CID 105456701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).