ethane;N,2,5-trimethylindazol-7-amine

C12H19N3 — CID 176566989

IUPACethane;N,2,5-trimethylindazol-7-amine
SMILESCC.CNc1cc(C)cc2cn(C)nc12
InChIInChI=1S/C10H13N3.C2H6/c1-7-4-8-6-13(3)12-10(8)9(5-7)11-2;1-2/h4-6,11H,1-3H3;1-2H3
InChIKeyVOKOPWQBTNNJEX-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.95
Rot. Bonds1

About ethane;N,2,5-trimethylindazol-7-amine

ethane;N,2,5-trimethylindazol-7-amine (PubChem CID 176566989) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is ethane;N,2,5-trimethylindazol-7-amine.

Molecular Properties

Compound Nameethane;N,2,5-trimethylindazol-7-amine
PubChem CID176566989
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC Nameethane;N,2,5-trimethylindazol-7-amine
SMILESCC.CNc1cc(C)cc2cn(C)nc12
InChIInChI=1S/C10H13N3.C2H6/c1-7-4-8-6-13(3)12-10(8)9(5-7)11-2;1-2/h4-6,11H,1-3H3;1-2H3
InChIKeyVOKOPWQBTNNJEX-UHFFFAOYSA-N
XLogP2.95
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;2,5,7-trimethylindazole
CID 156845071
ethane;7-fluoro-2,5-dimethylindazole;2,5,7-trimethylindazole
CID 156888629
5-amino-2,7-dimethylindazol-6-ol;2,5-dimethylindazol-7-amine;ethane
CID 176566536
ethane;2,5,7-trimethylindazol-6-ol
CID 162433004
5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine
CID 162432890
7-fluoro-2,6-dimethylindazol-5-amine;hydrochloride
CID 168914385
2,5-dimethylindazole
CID 58763639
ethane;2,6,7-trimethylindazole
CID 156845180
2-(1,3-dimethylpyrazol-4-yl)-5-fluoro-N-methylaniline
CID 175313734
2-[4-(2,7-dimethylindazol-5-yl)phenyl]-2-(methylamino)acetaldehyde
CID 143510786
4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide
CID 169370772
tert-butyl 4-[2-[2-methyl-7-(methylamino)indazol-5-yl]imidazo[2,1-b][1,3]thiazol-6-yl]piperidine-1-carboxylate
CID 178051083

Frequently Asked Questions

What is the IUPAC name of ethane;N,2,5-trimethylindazol-7-amine?
The IUPAC name of ethane;N,2,5-trimethylindazol-7-amine (CID 176566989) is ethane;N,2,5-trimethylindazol-7-amine.
What is the SMILES notation for ethane;N,2,5-trimethylindazol-7-amine?
The canonical SMILES for ethane;N,2,5-trimethylindazol-7-amine is CC.CNc1cc(C)cc2cn(C)nc12.
What is the InChIKey of ethane;N,2,5-trimethylindazol-7-amine?
The InChIKey is VOKOPWQBTNNJEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3.C2H6/c1-7-4-8-6-13(3)12-10(8)9(5-7)11-2;1-2/h4-6,11H,1-3H3;1-2H3.
What are the key properties of ethane;N,2,5-trimethylindazol-7-amine?
ethane;N,2,5-trimethylindazol-7-amine has a molecular weight of 205.30 g/mol, XLogP of 2.95, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N,2,5-trimethylindazol-7-amine is sourced from PubChem (CID 176566989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).