6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine

C10H12ClN5 — CID 84798908

IUPAC6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESClc1cnc2nc(C3CCCNC3)nn2c1
InChIInChI=1S/C10H12ClN5/c11-8-5-13-10-14-9(15-16(10)6-8)7-2-1-3-12-4-7/h5-7,12H,1-4H2
InChIKeyBGDNJZUQCNSDPM-UHFFFAOYSA-N
MW237.69 g/mol
LogP1.24
Rot. Bonds1

About 6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine

6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine (PubChem CID 84798908) has the molecular formula C10H12ClN5 and a molecular weight of 237.69 g/mol. Its IUPAC name is 6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
PubChem CID84798908
Molecular FormulaC10H12ClN5
Molecular Weight237.69 g/mol
Exact Mass237.08
IUPAC Name6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESClc1cnc2nc(C3CCCNC3)nn2c1
InChIInChI=1S/C10H12ClN5/c11-8-5-13-10-14-9(15-16(10)6-8)7-2-1-3-12-4-7/h5-7,12H,1-4H2
InChIKeyBGDNJZUQCNSDPM-UHFFFAOYSA-N
XLogP1.24
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.69
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-chloro-2-piperidin-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-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 84785460
7-methyl-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 83964859
6-chloro-2-piperidin-3-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine
CID 83964833
2-[(3R)-piperidin-3-yl]pyrimidine
CID 86328129
2-piperidin-3-ylpyrimidin-5-ol
CID 117231651
2,5-dichloro-4-piperidin-3-ylpyridine
CID 84694263
2-piperidin-3-yl-8-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 83964938
2-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 84671641
5-(1-methylpyrazol-4-yl)-3-piperidin-3-yl-1,2,4-oxadiazole
CID 63024578
4,6-dimethyl-2-piperidin-3-ylpyrimidine
CID 63317441
3-(azepan-4-yl)-5-chloropyridin-2-amine
CID 83261814
6-chloro-2-piperidin-4-ylimidazo[1,2-a]pyrimidine
CID 105498517

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
The IUPAC name of 6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine (CID 84798908) is 6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine.
What is the SMILES notation for 6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
The canonical SMILES for 6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine is Clc1cnc2nc(C3CCCNC3)nn2c1.
What is the InChIKey of 6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
The InChIKey is BGDNJZUQCNSDPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN5/c11-8-5-13-10-14-9(15-16(10)6-8)7-2-1-3-12-4-7/h5-7,12H,1-4H2.
What are the key properties of 6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine has a molecular weight of 237.69 g/mol, XLogP of 1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine is sourced from PubChem (CID 84798908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).