4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile

C20H15ClN6 — CID 16660558

IUPAC4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile
SMILESN#Cc1c(-c2ccccc2Cl)c(N)c2ccnn2c1NCc1cccnc1
InChIInChI=1S/C20H15ClN6/c21-16-6-2-1-5-14(16)18-15(10-22)20(25-12-13-4-3-8-24-11-13)27-17(19(18)23)7-9-26-27/h1-9,11,25H,12,23H2
InChIKeyNYZDORPUENVFRH-UHFFFAOYSA-N
MW374.84 g/mol
LogP4.12
Rot. Bonds4

About 4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile

4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile (PubChem CID 16660558) has the molecular formula C20H15ClN6 and a molecular weight of 374.84 g/mol. Its IUPAC name is 4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile.

Molecular Properties

Compound Name4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile
PubChem CID16660558
Molecular FormulaC20H15ClN6
Molecular Weight374.84 g/mol
Exact Mass374.10
IUPAC Name4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile
SMILESN#Cc1c(-c2ccccc2Cl)c(N)c2ccnn2c1NCc1cccnc1
InChIInChI=1S/C20H15ClN6/c21-16-6-2-1-5-14(16)18-15(10-22)20(25-12-13-4-3-8-24-11-13)27-17(19(18)23)7-9-26-27/h1-9,11,25H,12,23H2
InChIKeyNYZDORPUENVFRH-UHFFFAOYSA-N
XLogP4.12
TPSA92.03 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.84
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile?
The IUPAC name of 4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile (CID 16660558) is 4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile.
What is the SMILES notation for 4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile?
The canonical SMILES for 4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile is N#Cc1c(-c2ccccc2Cl)c(N)c2ccnn2c1NCc1cccnc1.
What is the InChIKey of 4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile?
The InChIKey is NYZDORPUENVFRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN6/c21-16-6-2-1-5-14(16)18-15(10-22)20(25-12-13-4-3-8-24-11-13)27-17(19(18)23)7-9-26-27/h1-9,11,25H,12,23H2.
What are the key properties of 4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile?
4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile has a molecular weight of 374.84 g/mol, XLogP of 4.12, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile is sourced from PubChem (CID 16660558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).