6-methyl-3H-indazol-7-amine

C8H9N3 — CID 124517588

IUPAC6-methyl-3H-indazol-7-amine
SMILESCc1ccc2c(c1N)N=NC2
InChIInChI=1S/C8H9N3/c1-5-2-3-6-4-10-11-8(6)7(5)9/h2-3H,4,9H2,1H3
InChIKeyIDOYIIXFVMNUFI-UHFFFAOYSA-N
MW147.18 g/mol
LogP2.17
Rot. Bonds

About 6-methyl-3H-indazol-7-amine

6-methyl-3H-indazol-7-amine (PubChem CID 124517588) has the molecular formula C8H9N3 and a molecular weight of 147.18 g/mol. Its IUPAC name is 6-methyl-3H-indazol-7-amine.

Molecular Properties

Compound Name6-methyl-3H-indazol-7-amine
PubChem CID124517588
Molecular FormulaC8H9N3
Molecular Weight147.18 g/mol
Exact Mass147.08
IUPAC Name6-methyl-3H-indazol-7-amine
SMILESCc1ccc2c(c1N)N=NC2
InChIInChI=1S/C8H9N3/c1-5-2-3-6-4-10-11-8(6)7(5)9/h2-3H,4,9H2,1H3
InChIKeyIDOYIIXFVMNUFI-UHFFFAOYSA-N
XLogP2.17
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

7-amino-4H-phthalazin-1-one
CID 69152645
2,3,6-trimethylaniline
CID 11958947
2-fluoro-3,6-dimethylaniline
CID 67968158
(1R)-6-methyl-2,3-dihydro-1H-indene-1,7-diamine
CID 130682325
2-(2,6-diamino-3-methylphenoxy)-4-methylbenzene-1,3-diamine
CID 168866150
3,6-dimethylbenzene-1,2-diamine;2,4,6-trimethylbenzene-1,3-diamine
CID 161457493
3-amino-4-methylbenzene-1,2-diol
CID 54091209
4,7-dimethyl-3H-indol-2-amine
CID 145358846
4-deuterio-2,6-dimethylaniline
CID 23423519
11,12-dihydrobenzo[c][1,2]benzodiazocine-3,8-diamine
CID 102235005
(2-amino-3,6-dimethylphenyl)methanol
CID 57370658
3-methyl-6-methylsulfanylbenzene-1,2-diamine
CID 66756534

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3H-indazol-7-amine?
The IUPAC name of 6-methyl-3H-indazol-7-amine (CID 124517588) is 6-methyl-3H-indazol-7-amine.
What is the SMILES notation for 6-methyl-3H-indazol-7-amine?
The canonical SMILES for 6-methyl-3H-indazol-7-amine is Cc1ccc2c(c1N)N=NC2.
What is the InChIKey of 6-methyl-3H-indazol-7-amine?
The InChIKey is IDOYIIXFVMNUFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3/c1-5-2-3-6-4-10-11-8(6)7(5)9/h2-3H,4,9H2,1H3.
What are the key properties of 6-methyl-3H-indazol-7-amine?
6-methyl-3H-indazol-7-amine has a molecular weight of 147.18 g/mol, XLogP of 2.17, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3H-indazol-7-amine is sourced from PubChem (CID 124517588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).