6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile

C12H10N4 — CID 167966199

IUPAC6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
SMILESN#Cc1cnn2cc(C3=CCCC3)cnc12
InChIInChI=1S/C12H10N4/c13-5-10-7-15-16-8-11(6-14-12(10)16)9-3-1-2-4-9/h3,6-8H,1-2,4H2
InChIKeyXLCWFZYGRQDPRT-UHFFFAOYSA-N
MW210.24 g/mol
LogP2.17
Rot. Bonds1

About 6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile

6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile (PubChem CID 167966199) has the molecular formula C12H10N4 and a molecular weight of 210.24 g/mol. Its IUPAC name is 6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile.

Molecular Properties

Compound Name6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
PubChem CID167966199
Molecular FormulaC12H10N4
Molecular Weight210.24 g/mol
Exact Mass210.09
IUPAC Name6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
SMILESN#Cc1cnn2cc(C3=CCCC3)cnc12
InChIInChI=1S/C12H10N4/c13-5-10-7-15-16-8-11(6-14-12(10)16)9-3-1-2-4-9/h3,6-8H,1-2,4H2
InChIKeyXLCWFZYGRQDPRT-UHFFFAOYSA-N
XLogP2.17
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

CID 170568234
CID 170568234
6-(4-methylnaphthalen-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 166386487
6-(2-cyclopropylimidazo[1,2-a]pyridin-7-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 166387695
6-(9-thiabicyclo[3.3.1]nonane-3-carbonyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 171948750
6-(2-ethylnaphthalen-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 170568244
pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 819275
6-[2-(4-fluorophenoxy)ethyl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 70706183
3-(3-cyanopyrazolo[1,5-a]pyrimidin-6-yl)-5-fluoro-N-(2-methyl-3-pyridinyl)benzamide
CID 169418083
6-(9-benzyl-9-azabicyclo[3.3.1]nonane-3-carbonyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 171948746
4-[6-[4-(cyclopentene-1-carbonyl)piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 155776171
13-methyl-12-oxido-2,6,7-triaza-12-azoniatricyclo[7.4.0.03,7]trideca-1,3,5,8,10,12-hexaene-4-carbonitrile
CID 11775830
5-(cyclopenten-1-yl)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine
CID 59238861

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile?
The IUPAC name of 6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile (CID 167966199) is 6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile.
What is the SMILES notation for 6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile?
The canonical SMILES for 6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile is N#Cc1cnn2cc(C3=CCCC3)cnc12.
What is the InChIKey of 6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile?
The InChIKey is XLCWFZYGRQDPRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4/c13-5-10-7-15-16-8-11(6-14-12(10)16)9-3-1-2-4-9/h3,6-8H,1-2,4H2.
What are the key properties of 6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile?
6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile has a molecular weight of 210.24 g/mol, XLogP of 2.17, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopenten-1-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile is sourced from PubChem (CID 167966199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).