N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide

C17H16N4O — CID 138380048

IUPACN-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide
SMILESO=C(NCc1[nH]nc2ncccc12)C1CCc2ccccc21
InChIInChI=1S/C17H16N4O/c22-17(13-8-7-11-4-1-2-5-12(11)13)19-10-15-14-6-3-9-18-16(14)21-20-15/h1-6,9,13H,7-8,10H2,(H,19,22)(H,18,20,21)
InChIKeySJHUJVGWLVUVFL-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.30
Rot. Bonds3

About N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide

N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide (PubChem CID 138380048) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide.

Molecular Properties

Compound NameN-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide
PubChem CID138380048
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC NameN-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide
SMILESO=C(NCc1[nH]nc2ncccc12)C1CCc2ccccc21
InChIInChI=1S/C17H16N4O/c22-17(13-8-7-11-4-1-2-5-12(11)13)19-10-15-14-6-3-9-18-16(14)21-20-15/h1-6,9,13H,7-8,10H2,(H,19,22)(H,18,20,21)
InChIKeySJHUJVGWLVUVFL-UHFFFAOYSA-N
XLogP2.30
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,5-dioxoimidazolidin-1-yl)-N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)acetamide
CID 138385422
2-(benzotriazol-2-yl)-N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)acetamide
CID 138809856
N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 55902019
N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide
CID 122559408
5-(difluoromethyl)-N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-1H-pyrazole-3-carboxamide
CID 138387015
(1R)-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 125131325
N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-3H-benzimidazole-5-carboxamide
CID 138384485
1-(1,3-benzothiazol-2-yl)-5-oxo-N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)pyrrolidine-3-carboxamide
CID 155508099
N-[(3-hydroxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 61150664
4-methoxy-N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)piperidine-4-carboxamide;hydrochloride
CID 154919007
3,5-difluoro-N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 138380246
1-(2,3-dihydro-1H-indene-1-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 77090586

Frequently Asked Questions

What is the IUPAC name of N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide?
The IUPAC name of N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide (CID 138380048) is N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide.
What is the SMILES notation for N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide?
The canonical SMILES for N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide is O=C(NCc1[nH]nc2ncccc12)C1CCc2ccccc21.
What is the InChIKey of N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide?
The InChIKey is SJHUJVGWLVUVFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c22-17(13-8-7-11-4-1-2-5-12(11)13)19-10-15-14-6-3-9-18-16(14)21-20-15/h1-6,9,13H,7-8,10H2,(H,19,22)(H,18,20,21).
What are the key properties of N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide?
N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 2.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-2,3-dihydro-1H-indene-1-carboxamide is sourced from PubChem (CID 138380048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).