N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide

C22H22N6O — CID 164605168

IUPACN-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
SMILESN#Cc1cc(-c2ccn3nc(NC(=O)C4CC4)cc3c2)c(NC2CCCC2)cn1
InChIInChI=1S/C22H22N6O/c23-12-17-10-19(20(13-24-17)25-16-3-1-2-4-16)15-7-8-28-18(9-15)11-21(27-28)26-22(29)14-5-6-14/h7-11,13-14,16,25H,1-6H2,(H,26,27,29)
InChIKeyYXCDQSSTUOIJBP-UHFFFAOYSA-N
MW386.46 g/mol
LogP3.97
Rot. Bonds5

About N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide

N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide (PubChem CID 164605168) has the molecular formula C22H22N6O and a molecular weight of 386.46 g/mol. Its IUPAC name is N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
PubChem CID164605168
Molecular FormulaC22H22N6O
Molecular Weight386.46 g/mol
Exact Mass386.19
IUPAC NameN-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
SMILESN#Cc1cc(-c2ccn3nc(NC(=O)C4CC4)cc3c2)c(NC2CCCC2)cn1
InChIInChI=1S/C22H22N6O/c23-12-17-10-19(20(13-24-17)25-16-3-1-2-4-16)15-7-8-28-18(9-15)11-21(27-28)26-22(29)14-5-6-14/h7-11,13-14,16,25H,1-6H2,(H,26,27,29)
InChIKeyYXCDQSSTUOIJBP-UHFFFAOYSA-N
XLogP3.97
TPSA95.11 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
The IUPAC name of N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide (CID 164605168) is N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide is N#Cc1cc(-c2ccn3nc(NC(=O)C4CC4)cc3c2)c(NC2CCCC2)cn1.
What is the InChIKey of N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
The InChIKey is YXCDQSSTUOIJBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N6O/c23-12-17-10-19(20(13-24-17)25-16-3-1-2-4-16)15-7-8-28-18(9-15)11-21(27-28)26-22(29)14-5-6-14/h7-11,13-14,16,25H,1-6H2,(H,26,27,29).
What are the key properties of N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide has a molecular weight of 386.46 g/mol, XLogP of 3.97, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-cyano-5-(cyclopentylamino)-4-pyridinyl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide is sourced from PubChem (CID 164605168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).