N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide

C22H18ClN5O2 — CID 162746618

IUPACN-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide
SMILESCC(=O)N(c1ccn2nccc2c1)c1cc(NC(=O)Cc2ccccc2Cl)ccn1
InChIInChI=1S/C22H18ClN5O2/c1-15(29)28(19-8-11-27-18(14-19)7-10-25-27)21-13-17(6-9-24-21)26-22(30)12-16-4-2-3-5-20(16)23/h2-11,13-14H,12H2,1H3,(H,24,26,30)
InChIKeyXGVOOOAWYIERGB-UHFFFAOYSA-N
MW419.87 g/mol
LogP4.25
Rot. Bonds5

About N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide

N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide (PubChem CID 162746618) has the molecular formula C22H18ClN5O2 and a molecular weight of 419.87 g/mol. Its IUPAC name is N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide
PubChem CID162746618
Molecular FormulaC22H18ClN5O2
Molecular Weight419.87 g/mol
Exact Mass419.11
IUPAC NameN-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide
SMILESCC(=O)N(c1ccn2nccc2c1)c1cc(NC(=O)Cc2ccccc2Cl)ccn1
InChIInChI=1S/C22H18ClN5O2/c1-15(29)28(19-8-11-27-18(14-19)7-10-25-27)21-13-17(6-9-24-21)26-22(30)12-16-4-2-3-5-20(16)23/h2-11,13-14H,12H2,1H3,(H,24,26,30)
InChIKeyXGVOOOAWYIERGB-UHFFFAOYSA-N
XLogP4.25
TPSA79.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.87
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide?
The IUPAC name of N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide (CID 162746618) is N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide.
What is the SMILES notation for N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide?
The canonical SMILES for N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide is CC(=O)N(c1ccn2nccc2c1)c1cc(NC(=O)Cc2ccccc2Cl)ccn1.
What is the InChIKey of N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide?
The InChIKey is XGVOOOAWYIERGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18ClN5O2/c1-15(29)28(19-8-11-27-18(14-19)7-10-25-27)21-13-17(6-9-24-21)26-22(30)12-16-4-2-3-5-20(16)23/h2-11,13-14H,12H2,1H3,(H,24,26,30).
What are the key properties of N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide?
N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide has a molecular weight of 419.87 g/mol, XLogP of 4.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(pyrazolo[1,5-a]pyridin-5-yl)amino]-4-pyridinyl]-2-(2-chlorophenyl)acetamide is sourced from PubChem (CID 162746618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).