7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol

C9H15N3O — CID 83906517

IUPAC7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol
SMILESCn1ncc2c1C(O)(CN)CCC2
InChIInChI=1S/C9H15N3O/c1-12-8-7(5-11-12)3-2-4-9(8,13)6-10/h5,13H,2-4,6,10H2,1H3
InChIKeyHQKURWCAKOONSW-UHFFFAOYSA-N
MW181.24 g/mol
LogP-0.10
Rot. Bonds1

About 7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol

7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol (PubChem CID 83906517) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol.

Molecular Properties

Compound Name7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol
PubChem CID83906517
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol
SMILESCn1ncc2c1C(O)(CN)CCC2
InChIInChI=1S/C9H15N3O/c1-12-8-7(5-11-12)3-2-4-9(8,13)6-10/h5,13H,2-4,6,10H2,1H3
InChIKeyHQKURWCAKOONSW-UHFFFAOYSA-N
XLogP-0.10
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1,7-dimethyl-3-(trifluoromethyl)-5,6-dihydro-4H-indazol-7-ol
CID 90167982
1-ethyl-7-methyl-3-(trifluoromethyl)-5,6-dihydro-4H-indazol-7-ol
CID 118357710
1-(Trifluoromethyl)-4,5,6,7-tetrahydroindazol-7-ol
CID 175970597
1-(1,4-Dimethylpyrazol-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol
CID 112742255
2-Methyl-4,5,6,7-tetrahydroindazol-7-ol
CID 84716484
2-(1,4-dimethyl-1H-pyrazol-5-yl)propan-2-ol
CID 115011986
1-Methyl-6-propan-2-yl-4,5,6,7-tetrahydroindazol-7-ol
CID 129296476
2-Methyl-6-propan-2-yl-4,5,6,7-tetrahydroindazol-7-ol
CID 129296490
6-Ethyl-2-methyl-4,5,6,7-tetrahydroindazol-7-ol
CID 129296511
6-Ethyl-1-methyl-4,5,6,7-tetrahydroindazol-7-ol
CID 145337721
Ethane;6-ethyl-2-methyl-4,5,6,7-tetrahydroindazol-7-ol
CID 145337739
6-Ethenyl-2-methyl-4,5,6,7-tetrahydroindazol-7-ol
CID 145337869

Frequently Asked Questions

What is the IUPAC name of 7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol?
The IUPAC name of 7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol (CID 83906517) is 7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol.
What is the SMILES notation for 7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol?
The canonical SMILES for 7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol is Cn1ncc2c1C(O)(CN)CCC2.
What is the InChIKey of 7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol?
The InChIKey is HQKURWCAKOONSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-12-8-7(5-11-12)3-2-4-9(8,13)6-10/h5,13H,2-4,6,10H2,1H3.
What are the key properties of 7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol?
7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol has a molecular weight of 181.24 g/mol, XLogP of -0.10, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol is sourced from PubChem (CID 83906517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).