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

C8H13N3O — CID 83905565

IUPAC7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol
SMILESNCC1(O)CCCc2cn[nH]c21
InChIInChI=1S/C8H13N3O/c9-5-8(12)3-1-2-6-4-10-11-7(6)8/h4,12H,1-3,5,9H2,(H,10,11)
InChIKeyVIVPSKLCKKFONV-UHFFFAOYSA-N
MW167.21 g/mol
LogP-0.11
Rot. Bonds1

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

7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol (PubChem CID 83905565) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol.

Molecular Properties

Compound Name7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol
PubChem CID83905565
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol
SMILESNCC1(O)CCCc2cn[nH]c21
InChIInChI=1S/C8H13N3O/c9-5-8(12)3-1-2-6-4-10-11-7(6)8/h4,12H,1-3,5,9H2,(H,10,11)
InChIKeyVIVPSKLCKKFONV-UHFFFAOYSA-N
XLogP-0.11
TPSA74.93 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 5-0.11
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
2-(1-Deuterio-4-methylpyrazol-3-yl)propan-2-ol
CID 175925932
7-(aminomethyl)-1-methyl-5,6-dihydro-4H-indazol-7-ol
CID 83906517
7-(aminomethyl)-2-methyl-5,6-dihydro-4H-indazol-7-ol
CID 83906518
7-(2-Aminoethyl)-1,4,5,6-tetrahydroindazol-7-ol
CID 83906524
2-(7-Hydroxy-1,4,5,6-tetrahydroindazol-7-yl)acetic acid
CID 83907954
7-(Aminomethyl)-3-bromo-1,4,5,6-tetrahydroindazol-7-ol
CID 83912911
(7R)-4,5,6,7-tetrahydro-1H-indazol-7-ol
CID 95241976

Frequently Asked Questions

What is the IUPAC name of 7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol?
The IUPAC name of 7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol (CID 83905565) is 7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol.
What is the SMILES notation for 7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol?
The canonical SMILES for 7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol is NCC1(O)CCCc2cn[nH]c21.
What is the InChIKey of 7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol?
The InChIKey is VIVPSKLCKKFONV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c9-5-8(12)3-1-2-6-4-10-11-7(6)8/h4,12H,1-3,5,9H2,(H,10,11).
What are the key properties of 7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol?
7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol has a molecular weight of 167.21 g/mol, XLogP of -0.11, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol is sourced from PubChem (CID 83905565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).