ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine

C11H17N3 — CID 144869732

IUPACethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine
SMILESCC.Cc1cc2n[nH]c(C)c2c(C)n1
InChIInChI=1S/C9H11N3.C2H6/c1-5-4-8-9(6(2)10-5)7(3)11-12-8;1-2/h4H,1-3H3,(H,11,12);1-2H3
InChIKeyHRTVJLBPDATKAF-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.91
Rot. Bonds

About ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine

ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine (PubChem CID 144869732) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Nameethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine
PubChem CID144869732
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Nameethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine
SMILESCC.Cc1cc2n[nH]c(C)c2c(C)n1
InChIInChI=1S/C9H11N3.C2H6/c1-5-4-8-9(6(2)10-5)7(3)11-12-8;1-2/h4H,1-3H3,(H,11,12);1-2H3
InChIKeyHRTVJLBPDATKAF-UHFFFAOYSA-N
XLogP2.91
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-chloro-4-fluoro-3-methyl-2H-indazole
CID 89425145
6-bromo-3-methyl-2H-indazol-4-amine
CID 24729381
6-chloro-4-fluoro-3,5-dimethyl-2H-indazole
CID 176567059
1,3,8,10-tetramethyl-2,9-phenanthroline
CID 118895261
3,6-dimethyl-2H-pyrazolo[4,3-c]pyridine
CID 58047438
6-bromo-4-methoxy-3-methyl-2H-indazole
CID 126681019
4-fluoro-3-methyl-6-pyrrolidin-1-yl-2H-indazole
CID 168513895
3,6-dimethyl-2H-pyrazolo[4,3-c]pyridine;molecular hydrogen
CID 144598952
4-fluoro-3-methyl-2H-indazole-6-carbonitrile
CID 172582021
4-fluoro-3-methyl-6-(4-methylphenyl)-2H-indazole
CID 164894380
4-bromo-3-methyl-2H-indazole-6-carbaldehyde
CID 117109587
1,3,7,8-tetramethyl-5H-pyrido[4,3-b]indole
CID 10680671

Frequently Asked Questions

What is the IUPAC name of ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine?
The IUPAC name of ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine (CID 144869732) is ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine is CC.Cc1cc2n[nH]c(C)c2c(C)n1.
What is the InChIKey of ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine?
The InChIKey is HRTVJLBPDATKAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3.C2H6/c1-5-4-8-9(6(2)10-5)7(3)11-12-8;1-2/h4H,1-3H3,(H,11,12);1-2H3.
What are the key properties of ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine?
ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine has a molecular weight of 191.28 g/mol, XLogP of 2.91, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3,4,6-trimethyl-2H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 144869732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).