3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine

C11H7ClN4 — CID 11299190

IUPAC3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine
SMILESClc1cnn2c(-c3cccnc3)ccnc12
InChIInChI=1S/C11H7ClN4/c12-9-7-15-16-10(3-5-14-11(9)16)8-2-1-4-13-6-8/h1-7H
InChIKeyJKJGYBCSOSSMBX-UHFFFAOYSA-N
MW230.66 g/mol
LogP2.44
Rot. Bonds1

About 3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine

3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine (PubChem CID 11299190) has the molecular formula C11H7ClN4 and a molecular weight of 230.66 g/mol. Its IUPAC name is 3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine
PubChem CID11299190
Molecular FormulaC11H7ClN4
Molecular Weight230.66 g/mol
Exact Mass230.04
IUPAC Name3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine
SMILESClc1cnn2c(-c3cccnc3)ccnc12
InChIInChI=1S/C11H7ClN4/c12-9-7-15-16-10(3-5-14-11(9)16)8-2-1-4-13-6-8/h1-7H
InChIKeyJKJGYBCSOSSMBX-UHFFFAOYSA-N
XLogP2.44
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.66
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine
CID 12766261
3-(2-ethoxyethyl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine
CID 70569912
3-bromo-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine;1-oxidopyridin-1-ium
CID 70527488
N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 166249777
7-bromo-3-chloropyrazolo[1,5-a]pyrimidine
CID 119081602
3-(3-chlorophenyl)-2-ethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine
CID 56921095
7-(4-chlorophenyl)-2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 66497872
4-pyridin-3-ylimidazo[1,5-a]pyrimidine-8-carbonitrile
CID 13117358
3-(4-chloro-1-pyridin-3-ylpyrazol-5-yl)pyridine
CID 174760347
2-ethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 12766254
3-(3-chlorophenyl)-7-(4-phenylphenyl)pyrazolo[1,5-a]pyrimidine
CID 3850835
N-(2-cyclopropyl-2-hydroxypropyl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 126830270

Frequently Asked Questions

What is the IUPAC name of 3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine (CID 11299190) is 3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine is Clc1cnn2c(-c3cccnc3)ccnc12.
What is the InChIKey of 3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine?
The InChIKey is JKJGYBCSOSSMBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClN4/c12-9-7-15-16-10(3-5-14-11(9)16)8-2-1-4-13-6-8/h1-7H.
What are the key properties of 3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine?
3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine has a molecular weight of 230.66 g/mol, XLogP of 2.44, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 11299190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).