(1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine

C12H21N3 — CID 83862092

IUPAC(1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine
SMILESCc1nn(C)c2c1C(CN)CC(C)(C)C2
InChIInChI=1S/C12H21N3/c1-8-11-9(7-13)5-12(2,3)6-10(11)15(4)14-8/h9H,5-7,13H2,1-4H3
InChIKeyXPTFMQMODZCCOF-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.74
Rot. Bonds1

About (1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine

(1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine (PubChem CID 83862092) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is (1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine.

Molecular Properties

Compound Name(1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine
PubChem CID83862092
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name(1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine
SMILESCc1nn(C)c2c1C(CN)CC(C)(C)C2
InChIInChI=1S/C12H21N3/c1-8-11-9(7-13)5-12(2,3)6-10(11)15(4)14-8/h9H,5-7,13H2,1-4H3
InChIKeyXPTFMQMODZCCOF-UHFFFAOYSA-N
XLogP1.74
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1,3-dimethyl-4,5,6,7-tetrahydroindazol-4-yl)methanamine
CID 82593140
(1,6,6-trimethyl-5,7-dihydro-4H-indazol-4-yl)methanamine
CID 83862086
(1,3,5,5-tetramethyl-6,7-dihydro-4H-indazol-4-yl)methanamine
CID 112716147
1,6,6-trimethyl-3-phenyl-5,7-dihydro-4H-indazol-4-amine
CID 66489197
1-(1,3-dimethyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-yl)-N-methylmethanamine
CID 83861590
1,6,6-trimethyl-5,7-dihydro-4H-benzimidazol-4-amine
CID 83875274
1-[(1,3-dimethylpyrazol-4-yl)methyl]-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine
CID 115991601
(3,3,7-trimethyl-2,4-dihydro-1H-naphthalen-1-yl)methanamine
CID 84620108
(3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-yl)methanamine
CID 83861564
N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine
CID 83861915
5,8,8,11-tetramethyl-11,12,13-triazatricyclo[8.3.0.04,6]trideca-1(10),12-diene
CID 167089079
4,4-dimethyl-2-(1,3,5-trimethylpyrazol-4-yl)-1,3-oxazolidine
CID 134613039

Frequently Asked Questions

What is the IUPAC name of (1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine?
The IUPAC name of (1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine (CID 83862092) is (1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine.
What is the SMILES notation for (1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine?
The canonical SMILES for (1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine is Cc1nn(C)c2c1C(CN)CC(C)(C)C2.
What is the InChIKey of (1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine?
The InChIKey is XPTFMQMODZCCOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-8-11-9(7-13)5-12(2,3)6-10(11)15(4)14-8/h9H,5-7,13H2,1-4H3.
What are the key properties of (1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine?
(1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine has a molecular weight of 207.32 g/mol, XLogP of 1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1,3,6,6-tetramethyl-5,7-dihydro-4H-indazol-4-yl)methanamine is sourced from PubChem (CID 83862092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).