7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol

C9H15N3O — CID 112714735

IUPAC7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol
SMILESCC1CCc2cn[nH]c2C1(O)CN
InChIInChI=1S/C9H15N3O/c1-6-2-3-7-4-11-12-8(7)9(6,13)5-10/h4,6,13H,2-3,5,10H2,1H3,(H,11,12)
InChIKeyPZOMLZVHQZZXID-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.14
Rot. Bonds1

About 7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol

7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol (PubChem CID 112714735) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol.

Molecular Properties

Compound Name7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol
PubChem CID112714735
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol
SMILESCC1CCc2cn[nH]c2C1(O)CN
InChIInChI=1S/C9H15N3O/c1-6-2-3-7-4-11-12-8(7)9(6,13)5-10/h4,6,13H,2-3,5,10H2,1H3,(H,11,12)
InChIKeyPZOMLZVHQZZXID-UHFFFAOYSA-N
XLogP0.14
TPSA74.93 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4,5,6,7-Tetrahydro-2H-indazol-7-ol
CID 54593563
6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol
CID 129296491
6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol
CID 129296585
ethane;6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol
CID 145337729
6-methyl-4,5,6,7-tetrahydro-1H-indazol-7-ol
CID 145337813
4-(1-Aminoethyl)-1,5,6,7-tetrahydroindazol-4-ol
CID 82408241
7-(Aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol
CID 83905565
4-(Aminomethyl)-1,5,6,7-tetrahydroindazol-4-ol
CID 83905567
7-(2-Aminoethyl)-1,4,5,6-tetrahydroindazol-7-ol
CID 83906524
4-(2-Aminoethyl)-1,5,6,7-tetrahydroindazol-4-ol
CID 83906525
2-[4-(2-adamantyl)-1H-pyrazol-5-yl]-2-hydroxypropanenitrile
CID 84096486
(7R)-4,5,6,7-tetrahydro-1H-indazol-7-ol
CID 95241976

Frequently Asked Questions

What is the IUPAC name of 7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol?
The IUPAC name of 7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol (CID 112714735) is 7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol.
What is the SMILES notation for 7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol?
The canonical SMILES for 7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol is CC1CCc2cn[nH]c2C1(O)CN.
What is the InChIKey of 7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol?
The InChIKey is PZOMLZVHQZZXID-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-6-2-3-7-4-11-12-8(7)9(6,13)5-10/h4,6,13H,2-3,5,10H2,1H3,(H,11,12).
What are the key properties of 7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol?
7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol has a molecular weight of 181.24 g/mol, XLogP of 0.14, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol is sourced from PubChem (CID 112714735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).