2-propan-2-yl-4,5,6,7-tetrahydroindazole

C10H16N2 — CID 59050198

IUPAC2-propan-2-yl-4,5,6,7-tetrahydroindazole
SMILESCC(C)n1cc2c(n1)CCCC2
InChIInChI=1S/C10H16N2/c1-8(2)12-7-9-5-3-4-6-10(9)11-12/h7-8H,3-6H2,1-2H3
InChIKeyMNKINMXADQQMLK-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.34
Rot. Bonds1

About 2-propan-2-yl-4,5,6,7-tetrahydroindazole

2-propan-2-yl-4,5,6,7-tetrahydroindazole (PubChem CID 59050198) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 2-propan-2-yl-4,5,6,7-tetrahydroindazole.

Molecular Properties

Compound Name2-propan-2-yl-4,5,6,7-tetrahydroindazole
PubChem CID59050198
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name2-propan-2-yl-4,5,6,7-tetrahydroindazole
SMILESCC(C)n1cc2c(n1)CCCC2
InChIInChI=1S/C10H16N2/c1-8(2)12-7-9-5-3-4-6-10(9)11-12/h7-8H,3-6H2,1-2H3
InChIKeyMNKINMXADQQMLK-UHFFFAOYSA-N
XLogP2.34
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-propan-2-yl-4,5,6,7-tetrahydroindazole-6-carbonitrile
CID 84719337
5-tert-butyl-2,5-di(propan-2-yl)-6,7-dihydro-4H-indazole
CID 122679816
2-propan-2-yl-4,5,6,7-tetrahydroindazol-4-ol
CID 84718398
2-propan-2-yl-4,5,6,7-tetrahydroindazole-5-carboxylic acid
CID 83863210
5-phenyl-2-propan-2-yl-4,5,6,7-tetrahydroindazole
CID 59050135
(2R)-2-amino-N-(2-propan-2-yl-4,5,6,7-tetrahydroindazol-6-yl)propanamide;hydrochloride
CID 119325314
N-methyl-2-propan-2-yl-5,6-dihydro-4H-cyclopenta[c]pyrazol-6-amine
CID 112712282
2-(2-methylpropyl)-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-one
CID 126857417
2-[(1-propan-2-ylpyrazol-4-yl)amino]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CID 62903567
2-(3-oxo-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridazin-2-yl)-N-propan-2-ylacetamide
CID 52903099
4-[[(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)amino]methyl]benzonitrile
CID 75484159
2-(4,5,6,7,8,9-hexahydrocycloocta[c]pyrazol-2-yl)acetic acid
CID 20887528

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-4,5,6,7-tetrahydroindazole?
The IUPAC name of 2-propan-2-yl-4,5,6,7-tetrahydroindazole (CID 59050198) is 2-propan-2-yl-4,5,6,7-tetrahydroindazole.
What is the SMILES notation for 2-propan-2-yl-4,5,6,7-tetrahydroindazole?
The canonical SMILES for 2-propan-2-yl-4,5,6,7-tetrahydroindazole is CC(C)n1cc2c(n1)CCCC2.
What is the InChIKey of 2-propan-2-yl-4,5,6,7-tetrahydroindazole?
The InChIKey is MNKINMXADQQMLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-8(2)12-7-9-5-3-4-6-10(9)11-12/h7-8H,3-6H2,1-2H3.
What are the key properties of 2-propan-2-yl-4,5,6,7-tetrahydroindazole?
2-propan-2-yl-4,5,6,7-tetrahydroindazole has a molecular weight of 164.25 g/mol, XLogP of 2.34, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-4,5,6,7-tetrahydroindazole is sourced from PubChem (CID 59050198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).