2,4-dimethyl-3,7-dihydroindazole;ethane

C11H18N2 — CID 145087226

IUPAC2,4-dimethyl-3,7-dihydroindazole;ethane
SMILESCC.CC1=C2CN(C)N=C2CC=C1
InChIInChI=1S/C9H12N2.C2H6/c1-7-4-3-5-9-8(7)6-11(2)10-9;1-2/h3-4H,5-6H2,1-2H3;1-2H3
InChIKeyNHLYCNXVZHCNJH-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.59
Rot. Bonds

About 2,4-dimethyl-3,7-dihydroindazole;ethane

2,4-dimethyl-3,7-dihydroindazole;ethane (PubChem CID 145087226) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 2,4-dimethyl-3,7-dihydroindazole;ethane.

Molecular Properties

Compound Name2,4-dimethyl-3,7-dihydroindazole;ethane
PubChem CID145087226
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name2,4-dimethyl-3,7-dihydroindazole;ethane
SMILESCC.CC1=C2CN(C)N=C2CC=C1
InChIInChI=1S/C9H12N2.C2H6/c1-7-4-3-5-9-8(7)6-11(2)10-9;1-2/h3-4H,5-6H2,1-2H3;1-2H3
InChIKeyNHLYCNXVZHCNJH-UHFFFAOYSA-N
XLogP2.59
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Ethyl-3-lithioindazole
CID 129784904
1,3-Dimethyl-5,7a-dihydroindazole
CID 21336393
2,5-Dimethyl-3,3a-dihydroindazole
CID 57584886
2-Methyl-3,3a-dihydroindazole
CID 69411514
2,7-Dimethyl-3,3a-dihydroindazole
CID 90251212
1,3-Dimethyl-5,7a-dihydroindazole;ethane
CID 90787896
2-Methyl-2-(2-methylpropyl)indazol-2-ium
CID 91165767
2-Methyl-4-propan-2-yl-3,7-dihydroindazole
CID 118124524
2,4-Dimethyl-3,7-dihydroindazole
CID 118133040
2,5-Dimethyl-3,3a-dihydropyrazolo[1,5-a]pyridine
CID 123536790
N-methyl-N-(3-methylidenehex-4-en-2-ylideneamino)ethanamine
CID 123591443
6-ethenyl-3-ethyl-1-methyl-8aH-cinnoline
CID 123729667

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-3,7-dihydroindazole;ethane?
The IUPAC name of 2,4-dimethyl-3,7-dihydroindazole;ethane (CID 145087226) is 2,4-dimethyl-3,7-dihydroindazole;ethane.
What is the SMILES notation for 2,4-dimethyl-3,7-dihydroindazole;ethane?
The canonical SMILES for 2,4-dimethyl-3,7-dihydroindazole;ethane is CC.CC1=C2CN(C)N=C2CC=C1.
What is the InChIKey of 2,4-dimethyl-3,7-dihydroindazole;ethane?
The InChIKey is NHLYCNXVZHCNJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2.C2H6/c1-7-4-3-5-9-8(7)6-11(2)10-9;1-2/h3-4H,5-6H2,1-2H3;1-2H3.
What are the key properties of 2,4-dimethyl-3,7-dihydroindazole;ethane?
2,4-dimethyl-3,7-dihydroindazole;ethane has a molecular weight of 178.28 g/mol, XLogP of 2.59, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-3,7-dihydroindazole;ethane is sourced from PubChem (CID 145087226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).