3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine

C18H15N3O3 — CID 71701058

IUPAC3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine
SMILESCOc1ccc(-c2cnn3c(-c4ccco4)ccnc23)cc1OC
InChIInChI=1S/C18H15N3O3/c1-22-16-6-5-12(10-17(16)23-2)13-11-20-21-14(7-8-19-18(13)21)15-4-3-9-24-15/h3-11H,1-2H3
InChIKeyLYVKMKCMUOGOQY-UHFFFAOYSA-N
MW321.34 g/mol
LogP3.67
Rot. Bonds4

About 3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine

3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine (PubChem CID 71701058) has the molecular formula C18H15N3O3 and a molecular weight of 321.34 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine
PubChem CID71701058
Molecular FormulaC18H15N3O3
Molecular Weight321.34 g/mol
Exact Mass321.11
IUPAC Name3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine
SMILESCOc1ccc(-c2cnn3c(-c4ccco4)ccnc23)cc1OC
InChIInChI=1S/C18H15N3O3/c1-22-16-6-5-12(10-17(16)23-2)13-11-20-21-14(7-8-19-18(13)21)15-4-3-9-24-15/h3-11H,1-2H3
InChIKeyLYVKMKCMUOGOQY-UHFFFAOYSA-N
XLogP3.67
TPSA61.79 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[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

7-(Furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 6485369
3-(2-fluorophenyl)-7-(furan-2-yl)-2-((2-methyl-2H-1,2,4-triazol-3-yl)methoxy)pyrazolo[1,5-d][1,2,4]triazine
CID 18406903
6-Amino-N-benzyl-4-(2-furyl)-1H-pyrazolo[3,4-d]pyrimidine-1-carboxamide
CID 22015504
1-[(3-Chlorophenyl)methyl]-4-(furan-2-yl)pyrazolo[3,4-d]pyrimidin-6-amine
CID 22015532
4-(Furan-2-yl)-10-[2-[4-(6-methyl-3-pyridinyl)phenyl]ethyl]-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine
CID 44568316
7-(Furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 1476956
3-(4-Bromophenyl)-7-(furan-2-yl)-2-methylpyrazolo[1,5-a]pyrimidine
CID 8073338
5-(1,3-benzodioxol-5-yl)-N-(2-furanylmethyl)-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide
CID 645580
4-(Furan-2-yl)-1-[(3-methoxyphenyl)methyl]pyrazolo[3,4-d]pyrimidin-6-amine
CID 9818556
A2A receptor antagonist 1
CID 9879687
4-(Furan-2-yl)-1-[(3-methylphenyl)methyl]pyrazolo[3,4-d]pyrimidin-6-amine
CID 9901099
7-(2-fluorobenzyl)-4-(2-furyl)-7H-pyrrolo[2,3-d]pyrimidine-2-amine
CID 9904688

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine (CID 71701058) is 3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine is COc1ccc(-c2cnn3c(-c4ccco4)ccnc23)cc1OC.
What is the InChIKey of 3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is LYVKMKCMUOGOQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O3/c1-22-16-6-5-12(10-17(16)23-2)13-11-20-21-14(7-8-19-18(13)21)15-4-3-9-24-15/h3-11H,1-2H3.
What are the key properties of 3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine?
3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 321.34 g/mol, XLogP of 3.67, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethoxyphenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 71701058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).