ethane;6-methyl-1H-indazol-3-amine

C12H21N3 — CID 143489720

IUPACethane;6-methyl-1H-indazol-3-amine
SMILESCC.CC.Cc1ccc2c(N)n[nH]c2c1
InChIInChI=1S/C8H9N3.2C2H6/c1-5-2-3-6-7(4-5)10-11-8(6)9;2*1-2/h2-4H,1H3,(H3,9,10,11);2*1-2H3
InChIKeyIEXVDCKKRPVMJX-UHFFFAOYSA-N
MW207.32 g/mol
LogP3.51
Rot. Bonds

About ethane;6-methyl-1H-indazol-3-amine

ethane;6-methyl-1H-indazol-3-amine (PubChem CID 143489720) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is ethane;6-methyl-1H-indazol-3-amine.

Molecular Properties

Compound Nameethane;6-methyl-1H-indazol-3-amine
PubChem CID143489720
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Nameethane;6-methyl-1H-indazol-3-amine
SMILESCC.CC.Cc1ccc2c(N)n[nH]c2c1
InChIInChI=1S/C8H9N3.2C2H6/c1-5-2-3-6-7(4-5)10-11-8(6)9;2*1-2/h2-4H,1H3,(H3,9,10,11);2*1-2H3
InChIKeyIEXVDCKKRPVMJX-UHFFFAOYSA-N
XLogP3.51
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;6-methyl-1H-indazol-3-amine?
The IUPAC name of ethane;6-methyl-1H-indazol-3-amine (CID 143489720) is ethane;6-methyl-1H-indazol-3-amine.
What is the SMILES notation for ethane;6-methyl-1H-indazol-3-amine?
The canonical SMILES for ethane;6-methyl-1H-indazol-3-amine is CC.CC.Cc1ccc2c(N)n[nH]c2c1.
What is the InChIKey of ethane;6-methyl-1H-indazol-3-amine?
The InChIKey is IEXVDCKKRPVMJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3.2C2H6/c1-5-2-3-6-7(4-5)10-11-8(6)9;2*1-2/h2-4H,1H3,(H3,9,10,11);2*1-2H3.
What are the key properties of ethane;6-methyl-1H-indazol-3-amine?
ethane;6-methyl-1H-indazol-3-amine has a molecular weight of 207.32 g/mol, XLogP of 3.51, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-methyl-1H-indazol-3-amine is sourced from PubChem (CID 143489720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).