(4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione

C15H14N4O2 — CID 135898351

IUPAC(4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
SMILESCc1ccc2c(c1)[C@@]1(CC(=O)Nc3[nH]ncc31)C(=O)N2C
InChIInChI=1S/C15H14N4O2/c1-8-3-4-11-9(5-8)15(14(21)19(11)2)6-12(20)17-13-10(15)7-16-18-13/h3-5,7H,6H2,1-2H3,(H2,16,17,18,20)/t15-/m1/s1
InChIKeyZTJVIPSQHUPZLS-OAHLLOKOSA-N
MW282.30 g/mol
LogP1.32
Rot. Bonds

About (4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione

(4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione (PubChem CID 135898351) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is (4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione.

Molecular Properties

Compound Name(4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
PubChem CID135898351
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name(4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
SMILESCc1ccc2c(c1)[C@@]1(CC(=O)Nc3[nH]ncc31)C(=O)N2C
InChIInChI=1S/C15H14N4O2/c1-8-3-4-11-9(5-8)15(14(21)19(11)2)6-12(20)17-13-10(15)7-16-18-13/h3-5,7H,6H2,1-2H3,(H2,16,17,18,20)/t15-/m1/s1
InChIKeyZTJVIPSQHUPZLS-OAHLLOKOSA-N
XLogP1.32
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione with MolForge

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Related Compounds

(4S)-5'-methyl-1'-prop-2-enylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
CID 135898398
(4S)-1',5'-dimethyl-1-[(4-methylphenyl)methyl]spiro[5,7-dihydropyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
CID 135953505
(4S)-1'-[(4-methylphenyl)methyl]spiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
CID 135950497
(4R)-5'-chloro-1'-methyl-1-[(4-methylphenyl)methyl]spiro[5,7-dihydropyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
CID 135940729
(4R)-7'-methyl-1'-prop-2-enylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
CID 135898239
(4R)-1'-prop-2-ynylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
CID 135901623
5'-[(4-chlorophenyl)methyl]spiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,7'-[1,3]dioxolo[4,5-f]indole]-6,6'-dione
CID 137012461
2-[(4R)-2',6-dioxospiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-1'-yl]-N-phenylacetamide
CID 135901621
(4S)-1'-ethyl-1-(4-methoxyphenyl)-5'-methylspiro[5,7-dihydropyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
CID 135941005
(4R)-1'-ethyl-1-(4-methoxyphenyl)-5'-methylspiro[5,7-dihydropyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
CID 135941006
(4S)-1-(3-chlorophenyl)-1'-ethyl-5'-methylspiro[5,7-dihydropyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
CID 135882829
1-tert-butyl-5'-methyl-1'-prop-2-enylspiro[5,7-dihydropyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione
CID 135655683

Frequently Asked Questions

What is the IUPAC name of (4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione?
The IUPAC name of (4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione (CID 135898351) is (4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione.
What is the SMILES notation for (4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione?
The canonical SMILES for (4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione is Cc1ccc2c(c1)[C@@]1(CC(=O)Nc3[nH]ncc31)C(=O)N2C.
What is the InChIKey of (4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione?
The InChIKey is ZTJVIPSQHUPZLS-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-8-3-4-11-9(5-8)15(14(21)19(11)2)6-12(20)17-13-10(15)7-16-18-13/h3-5,7H,6H2,1-2H3,(H2,16,17,18,20)/t15-/m1/s1.
What are the key properties of (4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione?
(4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione has a molecular weight of 282.30 g/mol, XLogP of 1.32, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1',5'-dimethylspiro[5,7-dihydro-1H-pyrazolo[5,4-b]pyridine-4,3'-indole]-2',6-dione is sourced from PubChem (CID 135898351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).