6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine

C11H15N5 — CID 84785460

IUPAC6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESCCc1cnc2nc(C3CCNC3)nn2c1
InChIInChI=1S/C11H15N5/c1-2-8-5-13-11-14-10(15-16(11)7-8)9-3-4-12-6-9/h5,7,9,12H,2-4,6H2,1H3
InChIKeyKBLCOURKJYTEJA-UHFFFAOYSA-N
MW217.28 g/mol
LogP0.76
Rot. Bonds2

About 6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine

6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine (PubChem CID 84785460) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
PubChem CID84785460
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESCCc1cnc2nc(C3CCNC3)nn2c1
InChIInChI=1S/C11H15N5/c1-2-8-5-13-11-14-10(15-16(11)7-8)9-3-4-12-6-9/h5,7,9,12H,2-4,6H2,1H3
InChIKeyKBLCOURKJYTEJA-UHFFFAOYSA-N
XLogP0.76
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 84798908
6-ethyl-2-piperidin-4-ylimidazo[1,2-a]pyrimidine
CID 105488507
5-ethyl-2-piperidin-4-ylpyrimidine
CID 83697990
2-(6-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)propan-2-amine
CID 84778565
2-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 84671641
5-ethyl-3-pyrrolidin-3-yl-1,2,4-triazine
CID 105437732
2-(azetidin-3-yl)-5-ethylpyrimidine
CID 84651719
8-methyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 117135835
3-ethyl-1-methyl-5-pyrrolidin-3-yl-1,2,4-triazole
CID 63032199
7-bromo-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 83844620
methyl 2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate
CID 117133580
8-methyl-2-pyrrolidin-3-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine
CID 117157636

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
The IUPAC name of 6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine (CID 84785460) is 6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine.
What is the SMILES notation for 6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
The canonical SMILES for 6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine is CCc1cnc2nc(C3CCNC3)nn2c1.
What is the InChIKey of 6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
The InChIKey is KBLCOURKJYTEJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-2-8-5-13-11-14-10(15-16(11)7-8)9-3-4-12-6-9/h5,7,9,12H,2-4,6H2,1H3.
What are the key properties of 6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine has a molecular weight of 217.28 g/mol, XLogP of 0.76, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine is sourced from PubChem (CID 84785460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).