7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine

C13H10ClN3O — CID 22308999

IUPAC7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine
SMILESClc1cc(-c2ccco2)nc2c(C3CC3)cnn12
InChIInChI=1S/C13H10ClN3O/c14-12-6-10(11-2-1-5-18-11)16-13-9(8-3-4-8)7-15-17(12)13/h1-2,5-8H,3-4H2
InChIKeyLLIJFGPQKDTPSH-UHFFFAOYSA-N
MW259.70 g/mol
LogP3.52
Rot. Bonds2

About 7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine

7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine (PubChem CID 22308999) has the molecular formula C13H10ClN3O and a molecular weight of 259.70 g/mol. Its IUPAC name is 7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine
PubChem CID22308999
Molecular FormulaC13H10ClN3O
Molecular Weight259.70 g/mol
Exact Mass259.05
IUPAC Name7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine
SMILESClc1cc(-c2ccco2)nc2c(C3CC3)cnn12
InChIInChI=1S/C13H10ClN3O/c14-12-6-10(11-2-1-5-18-11)16-13-9(8-3-4-8)7-15-17(12)13/h1-2,5-8H,3-4H2
InChIKeyLLIJFGPQKDTPSH-UHFFFAOYSA-N
XLogP3.52
TPSA43.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.70
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5,7-dichloro-3-cyclobutylpyrazolo[1,5-a]pyrimidine
CID 155104261
7-chloro-3-cyclopropyl-5-(dicyclopropylmethyl)pyrazolo[1,5-a]pyrimidine
CID 170418188
3-(3-chlorophenyl)-5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 40771635
5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 1370067
N-(2,3-dichlorophenyl)-5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 22333526
2-(2-cyclopropylphenyl)furan
CID 168526916
6-chloro-2-(furan-2-yl)imidazo[1,2-a]pyridin-8-amine
CID 82059442
CID 89023491
CID 89023491
2-chloro-6-(furan-2-yl)pyrimidin-4-amine
CID 66520852
N-[(4-chlorophenyl)methyl]-5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 2871894
N-[4-[(6-chloropyridazin-3-yl)amino]phenyl]-5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19575526
7-chloro-2-(furan-2-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 82270027

Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine (CID 22308999) is 7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine is Clc1cc(-c2ccco2)nc2c(C3CC3)cnn12.
What is the InChIKey of 7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is LLIJFGPQKDTPSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClN3O/c14-12-6-10(11-2-1-5-18-11)16-13-9(8-3-4-8)7-15-17(12)13/h1-2,5-8H,3-4H2.
What are the key properties of 7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine?
7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 259.70 g/mol, XLogP of 3.52, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-cyclopropyl-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 22308999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).