5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline

C15H10N4 — CID 175931882

IUPAC5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline
SMILESc1cc(-c2cnn3cccnc23)c2cccnc2c1
InChIInChI=1S/C15H10N4/c1-4-11(12-5-2-7-16-14(12)6-1)13-10-18-19-9-3-8-17-15(13)19/h1-10H
InChIKeyDXKSXHLGWXRMAV-UHFFFAOYSA-N
MW246.27 g/mol
LogP2.94
Rot. Bonds1

About 5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline

5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline (PubChem CID 175931882) has the molecular formula C15H10N4 and a molecular weight of 246.27 g/mol. Its IUPAC name is 5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline.

Molecular Properties

Compound Name5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline
PubChem CID175931882
Molecular FormulaC15H10N4
Molecular Weight246.27 g/mol
Exact Mass246.09
IUPAC Name5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline
SMILESc1cc(-c2cnn3cccnc23)c2cccnc2c1
InChIInChI=1S/C15H10N4/c1-4-11(12-5-2-7-16-14(12)6-1)13-10-18-19-9-3-8-17-15(13)19/h1-10H
InChIKeyDXKSXHLGWXRMAV-UHFFFAOYSA-N
XLogP2.94
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-pyrazolo[1,5-a]pyrimidin-3-yl-1,2,3,4-tetrahydroisoquinoline
CID 56880397
14-(2-quinolin-5-ylphenyl)-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene
CID 122435680
5-[6-[6-(2,6-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidin-3-yl]quinoline;ethane
CID 144728094
3-pyrazolo[1,5-a]pyrimidin-3-ylbenzonitrile
CID 122400853
5-(2,3-difluorophenyl)quinoline
CID 167880208
4-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine
CID 126667109
3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine
CID 71150900
4-(6-piperazin-1-ylpyrazolo[1,5-a]pyrimidin-3-yl)quinoline
CID 142464396
(2-quinolin-5-ylphenyl)methanol
CID 172649381
hexan-2-one;3-(2-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine
CID 161173714
(2-quinolin-5-ylphenyl)methanamine
CID 81224360
3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine
CID 170553720

Frequently Asked Questions

What is the IUPAC name of 5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline?
The IUPAC name of 5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline (CID 175931882) is 5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline.
What is the SMILES notation for 5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline?
The canonical SMILES for 5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline is c1cc(-c2cnn3cccnc23)c2cccnc2c1.
What is the InChIKey of 5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline?
The InChIKey is DXKSXHLGWXRMAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4/c1-4-11(12-5-2-7-16-14(12)6-1)13-10-18-19-9-3-8-17-15(13)19/h1-10H.
What are the key properties of 5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline?
5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline has a molecular weight of 246.27 g/mol, XLogP of 2.94, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrazolo[1,5-a]pyrimidin-3-ylquinoline is sourced from PubChem (CID 175931882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).