3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide

C24H18N6O2 — CID 90157223

IUPAC3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide
SMILESN#Cc1ccc(N(C(=O)c2ccn3ncc(-c4ccc(C(N)=O)nc4)c3c2)C2CC2)cc1
InChIInChI=1S/C24H18N6O2/c25-12-15-1-4-18(5-2-15)30(19-6-7-19)24(32)16-9-10-29-22(11-16)20(14-28-29)17-3-8-21(23(26)31)27-13-17/h1-5,8-11,13-14,19H,6-7H2,(H2,26,31)
InChIKeyJJXDASHHKUGLBN-UHFFFAOYSA-N
MW422.45 g/mol
LogP3.18
Rot. Bonds5

About 3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide

3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide (PubChem CID 90157223) has the molecular formula C24H18N6O2 and a molecular weight of 422.45 g/mol. Its IUPAC name is 3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide.

Molecular Properties

Compound Name3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide
PubChem CID90157223
Molecular FormulaC24H18N6O2
Molecular Weight422.45 g/mol
Exact Mass422.15
IUPAC Name3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide
SMILESN#Cc1ccc(N(C(=O)c2ccn3ncc(-c4ccc(C(N)=O)nc4)c3c2)C2CC2)cc1
InChIInChI=1S/C24H18N6O2/c25-12-15-1-4-18(5-2-15)30(19-6-7-19)24(32)16-9-10-29-22(11-16)20(14-28-29)17-3-8-21(23(26)31)27-13-17/h1-5,8-11,13-14,19H,6-7H2,(H2,26,31)
InChIKeyJJXDASHHKUGLBN-UHFFFAOYSA-N
XLogP3.18
TPSA117.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.45
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide?
The IUPAC name of 3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide (CID 90157223) is 3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide.
What is the SMILES notation for 3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide?
The canonical SMILES for 3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide is N#Cc1ccc(N(C(=O)c2ccn3ncc(-c4ccc(C(N)=O)nc4)c3c2)C2CC2)cc1.
What is the InChIKey of 3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide?
The InChIKey is JJXDASHHKUGLBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N6O2/c25-12-15-1-4-18(5-2-15)30(19-6-7-19)24(32)16-9-10-29-22(11-16)20(14-28-29)17-3-8-21(23(26)31)27-13-17/h1-5,8-11,13-14,19H,6-7H2,(H2,26,31).
What are the key properties of 3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide?
3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide has a molecular weight of 422.45 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide is sourced from PubChem (CID 90157223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).