ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine

C9H15N3 — CID 143402529

IUPACethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine
SMILESCC.Cn1ncc2c1NCC=C2
InChIInChI=1S/C7H9N3.C2H6/c1-10-7-6(5-9-10)3-2-4-8-7;1-2/h2-3,5,8H,4H2,1H3;1-2H3
InChIKeyKHTUJJSVYHYYEU-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.88
Rot. Bonds

About ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine

ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine (PubChem CID 143402529) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine.

Molecular Properties

Compound Nameethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine
PubChem CID143402529
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Nameethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine
SMILESCC.Cn1ncc2c1NCC=C2
InChIInChI=1S/C7H9N3.C2H6/c1-10-7-6(5-9-10)3-2-4-8-7;1-2/h2-3,5,8H,4H2,1H3;1-2H3
InChIKeyKHTUJJSVYHYYEU-UHFFFAOYSA-N
XLogP1.88
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,7-Dihydro-4-methyl-1-(2-methylpropyl)-6H-pyrazolo[3,4-b]pyridin-6-one
CID 135600423
5-cyclopropylidene-7-(difluoromethyl)-3-methyl-4H-pyrazolo[1,5-a]pyrimidine
CID 137305023
1,7-Dihydro-1,4-dimethyl-6H-pyrazolo[3,4-b]pyridin-6-one
CID 137219267
6-(5-amino-1-methylpyrazol-4-yl)-1H-pyrimidine-4-thione
CID 67989264
6-(3-amino-1-methylpyrazol-4-yl)-1H-pyrimidine-4-thione
CID 67989290
1-methyl-6H-pyrazolo[5,4-b]azepine
CID 123366036
1-Methyl-4-pent-1-enylpyrazol-5-amine
CID 123377825
4-ethenyl-N,1-dimethylpyrazol-5-amine
CID 123431681
1,8-dimethyl-6H-pyrazolo[5,4-b]azepin-8-ium
CID 123999754
2,6-dihydro-1H-pyrazolo[3,4-b]pyridine
CID 136082575
5-ethyl-1-methyl-7H-pyrazolo[5,4-b]pyridin-6-one
CID 136493968
1-Methyl-1H-pyrazolo[3,4-b]pyridin-6(7H)-one
CID 136494124

Frequently Asked Questions

What is the IUPAC name of ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine?
The IUPAC name of ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine (CID 143402529) is ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine.
What is the SMILES notation for ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine?
The canonical SMILES for ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine is CC.Cn1ncc2c1NCC=C2.
What is the InChIKey of ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine?
The InChIKey is KHTUJJSVYHYYEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3.C2H6/c1-10-7-6(5-9-10)3-2-4-8-7;1-2/h2-3,5,8H,4H2,1H3;1-2H3.
What are the key properties of ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine?
ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine has a molecular weight of 165.24 g/mol, XLogP of 1.88, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methyl-6,7-dihydropyrazolo[5,4-b]pyridine is sourced from PubChem (CID 143402529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).