(4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol

C9H15N3O — CID 83906531

IUPAC(4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol
SMILESCn1ncc2c1CCCC2(N)CO
InChIInChI=1S/C9H15N3O/c1-12-8-3-2-4-9(10,6-13)7(8)5-11-12/h5,13H,2-4,6,10H2,1H3
InChIKeyHOHXXXSSDOWRLN-UHFFFAOYSA-N
MW181.24 g/mol
LogP-0.10
Rot. Bonds1

About (4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol

(4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol (PubChem CID 83906531) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is (4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol.

Molecular Properties

Compound Name(4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol
PubChem CID83906531
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name(4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol
SMILESCn1ncc2c1CCCC2(N)CO
InChIInChI=1S/C9H15N3O/c1-12-8-3-2-4-9(10,6-13)7(8)5-11-12/h5,13H,2-4,6,10H2,1H3
InChIKeyHOHXXXSSDOWRLN-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

2-(4-amino-4,5,6,7-tetrahydro-1H-indazol-1-yl)ethan-1-ol
CID 43810753
(1-methyl-4,5,6,7-tetrahydro-1H-indazol-7-yl)methanol
CID 178199937
2-[(4R)-4-amino-4,5,6,7-tetrahydroindazol-1-yl]ethanol
CID 39870532
2-[4-(Propan-2-ylamino)-4,5,6,7-tetrahydroindazol-1-yl]ethanol
CID 43752553
2-[4-(Methylamino)-4,5,6,7-tetrahydroindazol-1-yl]ethanol
CID 65356487
2-(4-Methyl-4,5,6,7-tetrahydroindazol-1-yl)ethanol
CID 89208393
2-[4-(Tert-butylamino)-4,5,6,7-tetrahydroindazol-1-yl]ethanol
CID 129255730
2-tert-butylspiro[6,7-dihydro-5H-indazole-4,3'-oxetane]
CID 170203441
[1-(2-Trimethylsilylethoxymethyl)-4,5,6,7-tetrahydroindazol-4-yl]methanol
CID 170550593
2-[[4-(Methoxymethyl)-4,5,6,7-tetrahydroindazol-1-yl]methoxy]ethyl-trimethylsilane
CID 175489258
2-[(4S)-4-amino-4,5,6,7-tetrahydroindazol-1-yl]ethanol
CID 39870535
4-[(1-Methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]cyclohexan-1-ol
CID 43254573

Frequently Asked Questions

What is the IUPAC name of (4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol?
The IUPAC name of (4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol (CID 83906531) is (4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol.
What is the SMILES notation for (4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol?
The canonical SMILES for (4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol is Cn1ncc2c1CCCC2(N)CO.
What is the InChIKey of (4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol?
The InChIKey is HOHXXXSSDOWRLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-12-8-3-2-4-9(10,6-13)7(8)5-11-12/h5,13H,2-4,6,10H2,1H3.
What are the key properties of (4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol?
(4-amino-1-methyl-6,7-dihydro-5H-indazol-4-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 (4-amino-1-methyl-6,7-dihydro-5H-indazol-4-yl)methanol is sourced from PubChem (CID 83906531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).