ethane;5-methoxy-N-methylpyridin-3-amine

C11H22N2O — CID 168998921

IUPACethane;5-methoxy-N-methylpyridin-3-amine
SMILESCC.CC.CNc1cncc(OC)c1
InChIInChI=1S/C7H10N2O.2C2H6/c1-8-6-3-7(10-2)5-9-4-6;2*1-2/h3-5,8H,1-2H3;2*1-2H3
InChIKeyMUXKBPPTKGAGQT-UHFFFAOYSA-N
MW198.31 g/mol
LogP3.18
Rot. Bonds2

About ethane;5-methoxy-N-methylpyridin-3-amine

ethane;5-methoxy-N-methylpyridin-3-amine (PubChem CID 168998921) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is ethane;5-methoxy-N-methylpyridin-3-amine.

Molecular Properties

Compound Nameethane;5-methoxy-N-methylpyridin-3-amine
PubChem CID168998921
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Nameethane;5-methoxy-N-methylpyridin-3-amine
SMILESCC.CC.CNc1cncc(OC)c1
InChIInChI=1S/C7H10N2O.2C2H6/c1-8-6-3-7(10-2)5-9-4-6;2*1-2/h3-5,8H,1-2H3;2*1-2H3
InChIKeyMUXKBPPTKGAGQT-UHFFFAOYSA-N
XLogP3.18
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethane;5-methoxy-N-methylpyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethane;5-methoxy-N-methylpyridin-3-amine?
The IUPAC name of ethane;5-methoxy-N-methylpyridin-3-amine (CID 168998921) is ethane;5-methoxy-N-methylpyridin-3-amine.
What is the SMILES notation for ethane;5-methoxy-N-methylpyridin-3-amine?
The canonical SMILES for ethane;5-methoxy-N-methylpyridin-3-amine is CC.CC.CNc1cncc(OC)c1.
What is the InChIKey of ethane;5-methoxy-N-methylpyridin-3-amine?
The InChIKey is MUXKBPPTKGAGQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O.2C2H6/c1-8-6-3-7(10-2)5-9-4-6;2*1-2/h3-5,8H,1-2H3;2*1-2H3.
What are the key properties of ethane;5-methoxy-N-methylpyridin-3-amine?
ethane;5-methoxy-N-methylpyridin-3-amine has a molecular weight of 198.31 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methoxy-N-methylpyridin-3-amine is sourced from PubChem (CID 168998921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).