3-ethyl-4,5,6,7-tetrahydro-1H-indazole

C9H14N2 — CID 89205948

IUPAC3-ethyl-4,5,6,7-tetrahydro-1H-indazole
SMILESCCc1n[nH]c2c1CCCC2
InChIInChI=1S/C9H14N2/c1-2-8-7-5-3-4-6-9(7)11-10-8/h2-6H2,1H3,(H,10,11)
InChIKeyHEEOTDOLLAPMNY-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.85
Rot. Bonds1

About 3-ethyl-4,5,6,7-tetrahydro-1H-indazole

3-ethyl-4,5,6,7-tetrahydro-1H-indazole (PubChem CID 89205948) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 3-ethyl-4,5,6,7-tetrahydro-1H-indazole.

Molecular Properties

Compound Name3-ethyl-4,5,6,7-tetrahydro-1H-indazole
PubChem CID89205948
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name3-ethyl-4,5,6,7-tetrahydro-1H-indazole
SMILESCCc1n[nH]c2c1CCCC2
InChIInChI=1S/C9H14N2/c1-2-8-7-5-3-4-6-9(7)11-10-8/h2-6H2,1H3,(H,10,11)
InChIKeyHEEOTDOLLAPMNY-UHFFFAOYSA-N
XLogP1.85
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-Pentyl-4,5,6,7-tetrahydro-1H-indazole
CID 585962
3-(Trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole
CID 2802863
3-butyl-N-ethoxy-6,6-dimethyl-5,7-dihydroindazol-4-amine
CID 135569083
4,5,6,7-tetrahydro-2H-indazol-3-amine
CID 12211776
3,6,6-trimethyl-1,5,6,7-tetrahydro-4H-indazol-4-one oxime
CID 135449177
6,6-Dimethyl-3-propyl-1,5,6,7-tetrahydro-indazol-4-one O-ethyl-oxime
CID 135403078
3-tert-butyl-4,5,6,7-tetrahydro-1H-indazole
CID 852826
3,5-Diethyl-4-methylpyrazole
CID 139517
3-methyl-4,5,6,7-tetrahydro-1H-indazole
CID 312127
4-(3-Bromopropyl)-3,5-dimethyl-1H-pyrazole
CID 129600822
(NE)-N-(3-ethyl-1,5,6,7-tetrahydroindazol-4-ylidene)hydroxylamine
CID 135415460
3-ethyl-6,6-dimethyl-1,5,6,7-tetrahydro-4H-indazol-4-one oxime
CID 135449200

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4,5,6,7-tetrahydro-1H-indazole?
The IUPAC name of 3-ethyl-4,5,6,7-tetrahydro-1H-indazole (CID 89205948) is 3-ethyl-4,5,6,7-tetrahydro-1H-indazole.
What is the SMILES notation for 3-ethyl-4,5,6,7-tetrahydro-1H-indazole?
The canonical SMILES for 3-ethyl-4,5,6,7-tetrahydro-1H-indazole is CCc1n[nH]c2c1CCCC2.
What is the InChIKey of 3-ethyl-4,5,6,7-tetrahydro-1H-indazole?
The InChIKey is HEEOTDOLLAPMNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-2-8-7-5-3-4-6-9(7)11-10-8/h2-6H2,1H3,(H,10,11).
What are the key properties of 3-ethyl-4,5,6,7-tetrahydro-1H-indazole?
3-ethyl-4,5,6,7-tetrahydro-1H-indazole has a molecular weight of 150.22 g/mol, XLogP of 1.85, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4,5,6,7-tetrahydro-1H-indazole is sourced from PubChem (CID 89205948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).