7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol

C11H19N3O — CID 112716364

IUPAC7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol
SMILESCC1CCc2cn(C)nc2C1(O)CCN
InChIInChI=1S/C11H19N3O/c1-8-3-4-9-7-14(2)13-10(9)11(8,15)5-6-12/h7-8,15H,3-6,12H2,1-2H3
InChIKeyWCDKVNQQFQKWBI-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.54
Rot. Bonds2

About 7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol

7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol (PubChem CID 112716364) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol.

Molecular Properties

Compound Name7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol
PubChem CID112716364
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol
SMILESCC1CCc2cn(C)nc2C1(O)CCN
InChIInChI=1S/C11H19N3O/c1-8-3-4-9-7-14(2)13-10(9)11(8,15)5-6-12/h7-8,15H,3-6,12H2,1-2H3
InChIKeyWCDKVNQQFQKWBI-UHFFFAOYSA-N
XLogP0.54
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

7-(aminomethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol
CID 112715393
4-(2-aminoethyl)-2,5-dimethyl-6,7-dihydro-5H-isoindol-4-ol
CID 112716249
7-(2-aminoethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol
CID 112715402
4-(2-aminoethyl)-3,5-dimethyl-6,7-dihydro-5H-1,2-benzoxazol-4-ol
CID 112716488
(7-amino-2-methylspiro[4,5-dihydroindazole-6,1'-cyclopropane]-7-yl)methanol
CID 112716060
2-(4-hydroxy-2,5-dimethyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)acetic acid
CID 112716467
(3bS,8bR)-2,7-dimethyl-3b,4,5,8b,9,10-hexahydroindazolo[7,6-g]indazole
CID 90673956
(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-5-yl)methanamine
CID 82417278
1-(2-aminoethyl)-2,7-dimethylcycloheptan-1-ol
CID 83906952
4-(2-aminoethyl)-5-methyl-5,6-dihydrocyclopenta[b]thiophen-4-ol
CID 112715529
2-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-yl)ethanamine
CID 142262265
2,5-dimethyl-4,5,6,7-tetrahydroindazole-4-carboxylic acid
CID 112715296

Frequently Asked Questions

What is the IUPAC name of 7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol?
The IUPAC name of 7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol (CID 112716364) is 7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol.
What is the SMILES notation for 7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol?
The canonical SMILES for 7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol is CC1CCc2cn(C)nc2C1(O)CCN.
What is the InChIKey of 7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol?
The InChIKey is WCDKVNQQFQKWBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-8-3-4-9-7-14(2)13-10(9)11(8,15)5-6-12/h7-8,15H,3-6,12H2,1-2H3.
What are the key properties of 7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol?
7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol has a molecular weight of 209.29 g/mol, XLogP of 0.54, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-aminoethyl)-2,6-dimethyl-5,6-dihydro-4H-indazol-7-ol is sourced from PubChem (CID 112716364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).