3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine

C19H19N3 — CID 70089638

IUPAC3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine
SMILESCCCc1ccc2c(n1)NNC2c1cccc2ccccc12
InChIInChI=1S/C19H19N3/c1-2-6-14-11-12-17-18(21-22-19(17)20-14)16-10-5-8-13-7-3-4-9-15(13)16/h3-5,7-12,18,21H,2,6H2,1H3,(H,20,22)
InChIKeyGAGHAYDGYXOHOO-UHFFFAOYSA-N
MW289.38 g/mol
LogP4.21
Rot. Bonds3

About 3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine

3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine (PubChem CID 70089638) has the molecular formula C19H19N3 and a molecular weight of 289.38 g/mol. Its IUPAC name is 3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine
PubChem CID70089638
Molecular FormulaC19H19N3
Molecular Weight289.38 g/mol
Exact Mass289.16
IUPAC Name3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine
SMILESCCCc1ccc2c(n1)NNC2c1cccc2ccccc12
InChIInChI=1S/C19H19N3/c1-2-6-14-11-12-17-18(21-22-19(17)20-14)16-10-5-8-13-7-3-4-9-15(13)16/h3-5,7-12,18,21H,2,6H2,1H3,(H,20,22)
InChIKeyGAGHAYDGYXOHOO-UHFFFAOYSA-N
XLogP4.21
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 11217607
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CID 124638979
ethyl (4R)-6-methyl-4-naphthalen-1-yl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CID 691366
2-naphthalen-1-yl-4-propyl-2H-furan-5-one
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CID 79337694
5-naphthalen-1-yl-5H-tetrazole
CID 174663110
8-ethyl-2-propylquinoline
CID 58320607
3-propylphenanthro[9,10-c]pyridine
CID 71733890
1-(5-naphthalen-1-ylpyrazolidin-1-yl)ethanone
CID 175723534
N-methyl-3-naphthalen-1-ylcyclohexan-1-amine
CID 59830952
(4S,5R)-2-[2-[(4S,5R)-4,5-dinaphthalen-1-yl-4,5-dihydro-1,3-oxazol-2-yl]propan-2-yl]-4,5-dinaphthalen-1-yl-4,5-dihydro-1,3-oxazole
CID 66552817

Frequently Asked Questions

What is the IUPAC name of 3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine?
The IUPAC name of 3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine (CID 70089638) is 3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine?
The canonical SMILES for 3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine is CCCc1ccc2c(n1)NNC2c1cccc2ccccc12.
What is the InChIKey of 3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine?
The InChIKey is GAGHAYDGYXOHOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3/c1-2-6-14-11-12-17-18(21-22-19(17)20-14)16-10-5-8-13-7-3-4-9-15(13)16/h3-5,7-12,18,21H,2,6H2,1H3,(H,20,22).
What are the key properties of 3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine?
3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine has a molecular weight of 289.38 g/mol, XLogP of 4.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-1-yl-6-propyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 70089638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).