1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile

C11H10N4 — CID 84774895

IUPAC1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile
SMILESCc1cc2ncc(C3(C#N)CC3)cn2n1
InChIInChI=1S/C11H10N4/c1-8-4-10-13-5-9(6-15(10)14-8)11(7-12)2-3-11/h4-6H,2-3H2,1H3
InChIKeyDNYYZVFSANDVTA-UHFFFAOYSA-N
MW198.23 g/mol
LogP1.59
Rot. Bonds1

About 1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile

1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile (PubChem CID 84774895) has the molecular formula C11H10N4 and a molecular weight of 198.23 g/mol. Its IUPAC name is 1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile.

Molecular Properties

Compound Name1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile
PubChem CID84774895
Molecular FormulaC11H10N4
Molecular Weight198.23 g/mol
Exact Mass198.09
IUPAC Name1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile
SMILESCc1cc2ncc(C3(C#N)CC3)cn2n1
InChIInChI=1S/C11H10N4/c1-8-4-10-13-5-9(6-15(10)14-8)11(7-12)2-3-11/h4-6H,2-3H2,1H3
InChIKeyDNYYZVFSANDVTA-UHFFFAOYSA-N
XLogP1.59
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile?
The IUPAC name of 1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile (CID 84774895) is 1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile.
What is the SMILES notation for 1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile?
The canonical SMILES for 1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile is Cc1cc2ncc(C3(C#N)CC3)cn2n1.
What is the InChIKey of 1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile?
The InChIKey is DNYYZVFSANDVTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4/c1-8-4-10-13-5-9(6-15(10)14-8)11(7-12)2-3-11/h4-6H,2-3H2,1H3.
What are the key properties of 1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile?
1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile has a molecular weight of 198.23 g/mol, XLogP of 1.59, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)cyclopropane-1-carbonitrile is sourced from PubChem (CID 84774895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).