ethane;2-methylindazol-6-amine

C10H15N3 — CID 178017314

IUPACethane;2-methylindazol-6-amine
SMILESCC.Cn1cc2ccc(N)cc2n1
InChIInChI=1S/C8H9N3.C2H6/c1-11-5-6-2-3-7(9)4-8(6)10-11;1-2/h2-5H,9H2,1H3;1-2H3
InChIKeyPPAOGCXLEKNSIW-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.18
Rot. Bonds

About ethane;2-methylindazol-6-amine

ethane;2-methylindazol-6-amine (PubChem CID 178017314) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is ethane;2-methylindazol-6-amine.

Molecular Properties

Compound Nameethane;2-methylindazol-6-amine
PubChem CID178017314
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Nameethane;2-methylindazol-6-amine
SMILESCC.Cn1cc2ccc(N)cc2n1
InChIInChI=1S/C8H9N3.C2H6/c1-11-5-6-2-3-7(9)4-8(6)10-11;1-2/h2-5H,9H2,1H3;1-2H3
InChIKeyPPAOGCXLEKNSIW-UHFFFAOYSA-N
XLogP2.18
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.18
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

2-methylindazol-6-amine;dihydrochloride
CID 19354431
ethane;6-fluoro-2-methylindazole
CID 155591197
3-fluoro-4-(2-methylindazol-6-yl)oxyaniline
CID 166543843
2-butylindazol-6-amine
CID 165468380
5-fluoro-2-methylindazol-6-amine
CID 117110292
6-fluoro-2-methylindazol-5-amine
CID 118626680
2-(propan-2-yloxymethyl)indazol-6-amine
CID 165468375
2-cyclobutylindazol-6-amine
CID 90309050
2,6-dimethylpyrazolo[4,3-c]pyridine;ethane
CID 166543912
4-(2-methylindazol-6-yl)-1H-pyrimidine-2,4-diamine
CID 154199208
4-methyl-1-[(2-methylindazol-6-yl)methylideneamino]imidazol-2-amine
CID 168630728
3-chloro-2-fluoro-4-(2-methylindazol-6-yl)oxyaniline
CID 166543988

Frequently Asked Questions

What is the IUPAC name of ethane;2-methylindazol-6-amine?
The IUPAC name of ethane;2-methylindazol-6-amine (CID 178017314) is ethane;2-methylindazol-6-amine.
What is the SMILES notation for ethane;2-methylindazol-6-amine?
The canonical SMILES for ethane;2-methylindazol-6-amine is CC.Cn1cc2ccc(N)cc2n1.
What is the InChIKey of ethane;2-methylindazol-6-amine?
The InChIKey is PPAOGCXLEKNSIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3.C2H6/c1-11-5-6-2-3-7(9)4-8(6)10-11;1-2/h2-5H,9H2,1H3;1-2H3.
What are the key properties of ethane;2-methylindazol-6-amine?
ethane;2-methylindazol-6-amine has a molecular weight of 177.25 g/mol, XLogP of 2.18, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methylindazol-6-amine is sourced from PubChem (CID 178017314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).