(7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol

C9H15N3O — CID 83906529

IUPAC(7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol
SMILESCn1cc2c(n1)C(N)(CO)CCC2
InChIInChI=1S/C9H15N3O/c1-12-5-7-3-2-4-9(10,6-13)8(7)11-12/h5,13H,2-4,6,10H2,1H3
InChIKeyVXKKNKXVWBYPFZ-UHFFFAOYSA-N
MW181.24 g/mol
LogP-0.10
Rot. Bonds1

About (7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol

(7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol (PubChem CID 83906529) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is (7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol.

Molecular Properties

Compound Name(7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol
PubChem CID83906529
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name(7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol
SMILESCn1cc2c(n1)C(N)(CO)CCC2
InChIInChI=1S/C9H15N3O/c1-12-5-7-3-2-4-9(10,6-13)8(7)11-12/h5,13H,2-4,6,10H2,1H3
InChIKeyVXKKNKXVWBYPFZ-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-methyl-4,5,6,7-tetrahydro-1H-indazol-7-yl)methanol
CID 178199937
2-methyl-4,5,6,7-tetrahydro-2H-indazol-6-ol
CID 84716482
1-methyl-4,5,6,7-tetrahydro-1H-indazol-6-ol
CID 84716485
2-tert-butylspiro[5,6-dihydro-4H-indazole-7,3'-oxetane]
CID 170203438
(1-methyl-4,5,6,7-tetrahydro-1H-indazol-5-yl)methanol
CID 55253392
[3-Methyl-1-[(1-methyl-3-propan-2-ylpyrazol-4-yl)methylamino]cyclohexyl]methanol
CID 62551827
2-(1-Methyl-4,5,6,7-tetrahydro-1H-indazol-4-yl)ethanol
CID 71307728
2-amino-2-(1,4-dimethyl-1H-pyrazol-3-yl)ethan-1-ol
CID 82595634
[1-[(3-Tert-butyl-1-methylpyrazol-4-yl)methylamino]-3-methylcyclohexyl]methanol
CID 83090339
4-Amino-3-(3-tert-butyl-1-methylpyrazol-4-yl)-4-methylpentan-1-ol
CID 83094621
2-Amino-2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)ethanol
CID 83875780
(7-Amino-1,4,5,6-tetrahydroindazol-7-yl)methanol
CID 83905571

Frequently Asked Questions

What is the IUPAC name of (7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol?
The IUPAC name of (7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol (CID 83906529) is (7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol.
What is the SMILES notation for (7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol?
The canonical SMILES for (7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol is Cn1cc2c(n1)C(N)(CO)CCC2.
What is the InChIKey of (7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol?
The InChIKey is VXKKNKXVWBYPFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-12-5-7-3-2-4-9(10,6-13)8(7)11-12/h5,13H,2-4,6,10H2,1H3.
What are the key properties of (7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol?
(7-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol 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-amino-2-methyl-5,6-dihydro-4H-indazol-7-yl)methanol is sourced from PubChem (CID 83906529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).