2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile

C15H15N7 — CID 175797205

IUPAC2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESCc1c(-c2nn3ccccc3c2C#N)nnn1[C@@H]1CCNC1
InChIInChI=1S/C15H15N7/c1-10-14(18-20-22(10)11-5-6-17-9-11)15-12(8-16)13-4-2-3-7-21(13)19-15/h2-4,7,11,17H,5-6,9H2,1H3/t11-/m1/s1
InChIKeyPNKYEMNRHLLJHM-LLVKDONJSA-N
MW293.33 g/mol
LogP1.31
Rot. Bonds2

About 2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile

2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 175797205) has the molecular formula C15H15N7 and a molecular weight of 293.33 g/mol. Its IUPAC name is 2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile
PubChem CID175797205
Molecular FormulaC15H15N7
Molecular Weight293.33 g/mol
Exact Mass293.14
IUPAC Name2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESCc1c(-c2nn3ccccc3c2C#N)nnn1[C@@H]1CCNC1
InChIInChI=1S/C15H15N7/c1-10-14(18-20-22(10)11-5-6-17-9-11)15-12(8-16)13-4-2-3-7-21(13)19-15/h2-4,7,11,17H,5-6,9H2,1H3/t11-/m1/s1
InChIKeyPNKYEMNRHLLJHM-LLVKDONJSA-N
XLogP1.31
TPSA83.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The IUPAC name of 2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 175797205) is 2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile.
What is the SMILES notation for 2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The canonical SMILES for 2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile is Cc1c(-c2nn3ccccc3c2C#N)nnn1[C@@H]1CCNC1.
What is the InChIKey of 2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The InChIKey is PNKYEMNRHLLJHM-LLVKDONJSA-N. The full InChI is InChI=1S/C15H15N7/c1-10-14(18-20-22(10)11-5-6-17-9-11)15-12(8-16)13-4-2-3-7-21(13)19-15/h2-4,7,11,17H,5-6,9H2,1H3/t11-/m1/s1.
What are the key properties of 2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 293.33 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-methyl-1-[(3R)-pyrrolidin-3-yl]triazol-4-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 175797205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).