3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine

C11H19N3 — CID 84720212

IUPAC3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine
SMILESCc1c2c(nn1C(C)C)C(N)CCC2
InChIInChI=1S/C11H19N3/c1-7(2)14-8(3)9-5-4-6-10(12)11(9)13-14/h7,10H,4-6,12H2,1-3H3
InChIKeyVLTRWHRSAMZCNQ-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.11
Rot. Bonds1

About 3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine

3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine (PubChem CID 84720212) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine.

Molecular Properties

Compound Name3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine
PubChem CID84720212
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine
SMILESCc1c2c(nn1C(C)C)C(N)CCC2
InChIInChI=1S/C11H19N3/c1-7(2)14-8(3)9-5-4-6-10(12)11(9)13-14/h7,10H,4-6,12H2,1-3H3
InChIKeyVLTRWHRSAMZCNQ-UHFFFAOYSA-N
XLogP2.11
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-2,6-di(propan-2-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole
CID 158533758
(1S)-2,3-dimethylcyclohex-2-en-1-amine
CID 129374983
N-(dicyclopropylmethyl)-3,5-dimethyl-1-propan-2-ylpyrazol-4-amine
CID 54866491
1-propan-2-yl-4,5,6,7-tetrahydroindazol-3-amine
CID 83862378
2-propyl-4,5,6,7-tetrahydroindazol-7-amine
CID 104704114
(7R)-2-cyclopentyl-4,5,6,7-tetrahydroindazol-7-amine
CID 97297718
(8S)-4-methoxy-5,6,7,8-tetrahydroquinolin-8-amine
CID 97184033
3-(1,1-difluoroethyl)-7-methyl-1-propan-2-yl-4,5,6,7-tetrahydroindazole
CID 90162023
2-(1-methoxypropan-2-yl)-4,5,6,7-tetrahydro-1,3-benzothiazol-4-amine
CID 116502767
1-methyl-5,6,7,8-tetrahydroisoquinolin-5-amine
CID 175312266
1-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carbaldehyde
CID 112711168
(4S)-1-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine
CID 97181754

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine?
The IUPAC name of 3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine (CID 84720212) is 3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine.
What is the SMILES notation for 3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine?
The canonical SMILES for 3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine is Cc1c2c(nn1C(C)C)C(N)CCC2.
What is the InChIKey of 3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine?
The InChIKey is VLTRWHRSAMZCNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-7(2)14-8(3)9-5-4-6-10(12)11(9)13-14/h7,10H,4-6,12H2,1-3H3.
What are the key properties of 3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine?
3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine has a molecular weight of 193.29 g/mol, XLogP of 2.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-amine is sourced from PubChem (CID 84720212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).