(7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol

C9H15N3O — CID 112714742

IUPAC(7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol
SMILESCC1CCc2cn[nH]c2C1(N)CO
InChIInChI=1S/C9H15N3O/c1-6-2-3-7-4-11-12-8(7)9(6,10)5-13/h4,6,13H,2-3,5,10H2,1H3,(H,11,12)
InChIKeyRZFIPFWXYSVVQR-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.14
Rot. Bonds1

About (7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol

(7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol (PubChem CID 112714742) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is (7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol.

Molecular Properties

Compound Name(7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol
PubChem CID112714742
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name(7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol
SMILESCC1CCc2cn[nH]c2C1(N)CO
InChIInChI=1S/C9H15N3O/c1-6-2-3-7-4-11-12-8(7)9(6,10)5-13/h4,6,13H,2-3,5,10H2,1H3,(H,11,12)
InChIKeyRZFIPFWXYSVVQR-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-1H-indazol-4-yl)methanol
CID 155978058
4,5,6,7-tetrahydro-1H-indazol-5-ylmethanol
CID 55253391
[(5R,6S)-5-methyl-4,5,6,7-tetrahydro-1H-indazol-6-yl]methanol
CID 141417459
[(5R,6S)-5-[(4R,5S)-4-(hydroxymethyl)-1,1-dimethyl-2,3,4,5,6,7-hexahydroinden-5-yl]-5-methyl-1,4,6,7-tetrahydroindazol-6-yl]methanol
CID 156390745
[(5R,6S)-5-[(2S,3S)-1-azido-2-[(1R)-3-methylidenecyclopentyl]heptan-3-yl]-5-methyl-1,4,6,7-tetrahydroindazol-6-yl]methanol
CID 156408213
[5-[(4R,5S)-4-(hydroxymethyl)-1,1-dimethyl-2,3,4,5,6,7-hexahydroinden-5-yl]-5-methyl-1,4,6,7-tetrahydroindazol-6-yl]methanol
CID 175102402
(7-Amino-1,4,5,6-tetrahydroindazol-7-yl)methanol
CID 83905571
(4-Amino-1,5,6,7-tetrahydroindazol-4-yl)methanol
CID 83905573
(7-amino-1-methyl-5,6-dihydro-4H-indazol-7-yl)methanol
CID 83906528
2-[4-(2-adamantyl)-1H-pyrazol-5-yl]-2-aminoethanol
CID 84096551
(4-Amino-5-methyl-1,5,6,7-tetrahydroindazol-4-yl)methanol
CID 112714744
(7-aminospiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-yl)methanol
CID 112715120

Frequently Asked Questions

What is the IUPAC name of (7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol?
The IUPAC name of (7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol (CID 112714742) is (7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol.
What is the SMILES notation for (7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol?
The canonical SMILES for (7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol is CC1CCc2cn[nH]c2C1(N)CO.
What is the InChIKey of (7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol?
The InChIKey is RZFIPFWXYSVVQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-6-2-3-7-4-11-12-8(7)9(6,10)5-13/h4,6,13H,2-3,5,10H2,1H3,(H,11,12).
What are the key properties of (7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol?
(7-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol 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-amino-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)methanol is sourced from PubChem (CID 112714742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).