ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine

C11H17N3 — CID 171795656

IUPACethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine
SMILESCC.CC(C)c1cc2cn[nH]c2cn1
InChIInChI=1S/C9H11N3.C2H6/c1-6(2)8-3-7-4-11-12-9(7)5-10-8;1-2/h3-6H,1-2H3,(H,11,12);1-2H3
InChIKeyRNGPJSRIERQORV-UHFFFAOYSA-N
MW191.28 g/mol
LogP3.11
Rot. Bonds1

About ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine

ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine (PubChem CID 171795656) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Nameethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine
PubChem CID171795656
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Nameethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine
SMILESCC.CC(C)c1cc2cn[nH]c2cn1
InChIInChI=1S/C9H11N3.C2H6/c1-6(2)8-3-7-4-11-12-9(7)5-10-8;1-2/h3-6H,1-2H3,(H,11,12);1-2H3
InChIKeyRNGPJSRIERQORV-UHFFFAOYSA-N
XLogP3.11
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methylsulfanyl-1H-pyrazolo[3,4-c]pyridine
CID 156566273
6-methyl-5-propan-2-yl-1H-indazole
CID 58371515
ethyl 3,4-dihydroxy-4-(1H-pyrazolo[3,4-c]pyridin-5-yl)butanoate
CID 171897561
ethane;2,4,5-tri(propan-2-yl)pyridine
CID 167652229
ethane;molecular hydrogen;6-propan-2-yl-3H-imidazo[4,5-c]pyridine
CID 171660115
3-propan-2-yl-5H-pyridazino[4,3-c]pyridazin-8-one
CID 166563740
ethane;5-methyl-1H-indazole
CID 178026047
azane;5-(4-propan-2-ylphenyl)-1H-indazole;dihydrochloride
CID 175178296
6-propan-2-ylpyrido[3,4-d]pyrimidine
CID 59592820
N,N-dimethyl-5-(1H-pyrazolo[3,4-c]pyridin-5-yl)pyridin-3-amine
CID 126553618
(1R)-1-(1H-indazol-5-yl)-2-methylpropan-1-amine
CID 130948805
3-(1H-pyrazolo[3,4-c]pyridin-5-yl)prop-2-yn-1-ol
CID 169485143

Frequently Asked Questions

What is the IUPAC name of ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine?
The IUPAC name of ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine (CID 171795656) is ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine?
The canonical SMILES for ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine is CC.CC(C)c1cc2cn[nH]c2cn1.
What is the InChIKey of ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine?
The InChIKey is RNGPJSRIERQORV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3.C2H6/c1-6(2)8-3-7-4-11-12-9(7)5-10-8;1-2/h3-6H,1-2H3,(H,11,12);1-2H3.
What are the key properties of ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine?
ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine has a molecular weight of 191.28 g/mol, XLogP of 3.11, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-propan-2-yl-1H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 171795656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).