potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane

C9H18KNO — CID 142256399

IUPACpotassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane
SMILESCC.C[N-]CC1=CCCCO1.[K+]
InChIInChI=1S/C7H12NO.C2H6.K/c1-8-6-7-4-2-3-5-9-7;1-2;/h4H,2-3,5-6H2,1H3;1-2H3;/q-1;;+1
InChIKeyXJAAZMIAVWFXRT-UHFFFAOYSA-N
MW195.35 g/mol
LogP-0.29
Rot. Bonds2

About potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane

potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane (PubChem CID 142256399) has the molecular formula C9H18KNO and a molecular weight of 195.35 g/mol. Its IUPAC name is potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane.

Molecular Properties

Compound Namepotassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane
PubChem CID142256399
Molecular FormulaC9H18KNO
Molecular Weight195.35 g/mol
Exact Mass195.10
IUPAC Namepotassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane
SMILESCC.C[N-]CC1=CCCCO1.[K+]
InChIInChI=1S/C7H12NO.C2H6.K/c1-8-6-7-4-2-3-5-9-7;1-2;/h4H,2-3,5-6H2,1H3;1-2H3;/q-1;;+1
InChIKeyXJAAZMIAVWFXRT-UHFFFAOYSA-N
XLogP-0.29
TPSA23.33 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 5-0.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane?
The IUPAC name of potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane (CID 142256399) is potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane.
What is the SMILES notation for potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane?
The canonical SMILES for potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane is CC.C[N-]CC1=CCCCO1.[K+].
What is the InChIKey of potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane?
The InChIKey is XJAAZMIAVWFXRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12NO.C2H6.K/c1-8-6-7-4-2-3-5-9-7;1-2;/h4H,2-3,5-6H2,1H3;1-2H3;/q-1;;+1.
What are the key properties of potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane?
potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane has a molecular weight of 195.35 g/mol, XLogP of -0.29, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;3,4-dihydro-2H-pyran-6-ylmethyl(methyl)azanide;ethane is sourced from PubChem (CID 142256399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).