5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane

C9H18N2OS — CID 176679300

IUPAC5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane
SMILESCCc1ccc(NC)nc1OC.S.[H][H]
InChIInChI=1S/C9H14N2O.H2S.H2/c1-4-7-5-6-8(10-2)11-9(7)12-3;;/h5-6H,4H2,1-3H3,(H,10,11);1H2;1H
InChIKeyHFGNPDMGDZZBSW-UHFFFAOYSA-N
MW202.32 g/mol
LogP2.05
Rot. Bonds3

About 5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane

5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane (PubChem CID 176679300) has the molecular formula C9H18N2OS and a molecular weight of 202.32 g/mol. Its IUPAC name is 5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane.

Molecular Properties

Compound Name5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane
PubChem CID176679300
Molecular FormulaC9H18N2OS
Molecular Weight202.32 g/mol
Exact Mass202.11
IUPAC Name5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane
SMILESCCc1ccc(NC)nc1OC.S.[H][H]
InChIInChI=1S/C9H14N2O.H2S.H2/c1-4-7-5-6-8(10-2)11-9(7)12-3;;/h5-6H,4H2,1-3H3,(H,10,11);1H2;1H
InChIKeyHFGNPDMGDZZBSW-UHFFFAOYSA-N
XLogP2.05
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane?
The IUPAC name of 5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane (CID 176679300) is 5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane.
What is the SMILES notation for 5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane?
The canonical SMILES for 5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane is CCc1ccc(NC)nc1OC.S.[H][H].
What is the InChIKey of 5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane?
The InChIKey is HFGNPDMGDZZBSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O.H2S.H2/c1-4-7-5-6-8(10-2)11-9(7)12-3;;/h5-6H,4H2,1-3H3,(H,10,11);1H2;1H.
What are the key properties of 5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane?
5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane has a molecular weight of 202.32 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-methoxy-N-methylpyridin-2-amine;molecular hydrogen;sulfane is sourced from PubChem (CID 176679300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).