N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide

C21H19N5O — CID 159506062

IUPACN-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide
SMILESO=C(Cc1cc2cnn(-c3ccncc3)c2cn1)NCCc1ccccc1
InChIInChI=1S/C21H19N5O/c27-21(23-11-6-16-4-2-1-3-5-16)13-18-12-17-14-25-26(20(17)15-24-18)19-7-9-22-10-8-19/h1-5,7-10,12,14-15H,6,11,13H2,(H,23,27)
InChIKeyLZZQDVRZGUWOKK-UHFFFAOYSA-N
MW357.42 g/mol
LogP2.72
Rot. Bonds6

About N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide

N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide (PubChem CID 159506062) has the molecular formula C21H19N5O and a molecular weight of 357.42 g/mol. Its IUPAC name is N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide.

Molecular Properties

Compound NameN-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide
PubChem CID159506062
Molecular FormulaC21H19N5O
Molecular Weight357.42 g/mol
Exact Mass357.16
IUPAC NameN-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide
SMILESO=C(Cc1cc2cnn(-c3ccncc3)c2cn1)NCCc1ccccc1
InChIInChI=1S/C21H19N5O/c27-21(23-11-6-16-4-2-1-3-5-16)13-18-12-17-14-25-26(20(17)15-24-18)19-7-9-22-10-8-19/h1-5,7-10,12,14-15H,6,11,13H2,(H,23,27)
InChIKeyLZZQDVRZGUWOKK-UHFFFAOYSA-N
XLogP2.72
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.42
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1R)-1-(4-fluorophenyl)ethyl]-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide
CID 147153289
N-methyl-4-[4-[1-(2-methyl-4-pyridinyl)pyrazolo[3,4-c]pyridin-5-yl]-3-oxobutyl]benzamide
CID 160656274
1-[(3R,4R)-1-methyl-4-(3-phenylpropyl)pyrrolidin-3-yl]-3-[1-(2-methyl-4-pyridinyl)pyrazolo[3,4-c]pyridin-5-yl]propan-2-one
CID 158224666
N-(1-methyl-4-phenylpyrrolidin-3-yl)-2-[1-(2-methyl-4-pyridinyl)pyrazolo[3,4-c]pyridin-5-yl]acetamide
CID 159211873
N-(2-phenylethyl)-2-(pyridin-2-ylmethylamino)acetamide
CID 108999079
2-hydroxy-N-(2-pyridin-4-ylethyl)acetamide
CID 83816903
2-naphthalen-2-yl-N-(2-phenylethyl)acetamide
CID 26913082
5-methyl-1-phenyl-N-(2-phenylethyl)pyrazole-4-carboxamide
CID 11098783
2-(2-amino-1,3-thiazol-4-yl)-N-(2-phenylethyl)acetamide
CID 3561835
2-[1-(2-methyl-4-pyridinyl)pyrazolo[3,4-c]pyridin-5-yl]-N-[(3S,4R)-1,2,2-trimethyl-4-(2-methylphenyl)pyrrolidin-3-yl]acetamide
CID 159397030
[2-oxo-2-(2-phenylethylamino)ethyl] pyridine-4-carboxylate
CID 3483038
2-phenyl-N-(2-quinoxalin-2-ylethyl)acetamide
CID 130474108

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide?
The IUPAC name of N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide (CID 159506062) is N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide.
What is the SMILES notation for N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide?
The canonical SMILES for N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide is O=C(Cc1cc2cnn(-c3ccncc3)c2cn1)NCCc1ccccc1.
What is the InChIKey of N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide?
The InChIKey is LZZQDVRZGUWOKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O/c27-21(23-11-6-16-4-2-1-3-5-16)13-18-12-17-14-25-26(20(17)15-24-18)19-7-9-22-10-8-19/h1-5,7-10,12,14-15H,6,11,13H2,(H,23,27).
What are the key properties of N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide?
N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide has a molecular weight of 357.42 g/mol, XLogP of 2.72, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)-2-(1-pyridin-4-ylpyrazolo[3,4-c]pyridin-5-yl)acetamide is sourced from PubChem (CID 159506062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).