ethane;1-ethyl-2-methylpyrrolidine;methanol

C12H31NO — CID 144741574

IUPACethane;1-ethyl-2-methylpyrrolidine;methanol
SMILESCC.CC.CCN1CCCC1C.CO
InChIInChI=1S/C7H15N.2C2H6.CH4O/c1-3-8-6-4-5-7(8)2;3*1-2/h7H,3-6H2,1-2H3;2*1-2H3;2H,1H3
InChIKeySLHVFONKZAWKET-UHFFFAOYSA-N
MW205.39 g/mol
LogP3.15
Rot. Bonds1

About ethane;1-ethyl-2-methylpyrrolidine;methanol

ethane;1-ethyl-2-methylpyrrolidine;methanol (PubChem CID 144741574) has the molecular formula C12H31NO and a molecular weight of 205.39 g/mol. Its IUPAC name is ethane;1-ethyl-2-methylpyrrolidine;methanol.

Molecular Properties

Compound Nameethane;1-ethyl-2-methylpyrrolidine;methanol
PubChem CID144741574
Molecular FormulaC12H31NO
Molecular Weight205.39 g/mol
Exact Mass205.24
IUPAC Nameethane;1-ethyl-2-methylpyrrolidine;methanol
SMILESCC.CC.CCN1CCCC1C.CO
InChIInChI=1S/C7H15N.2C2H6.CH4O/c1-3-8-6-4-5-7(8)2;3*1-2/h7H,3-6H2,1-2H3;2*1-2H3;2H,1H3
InChIKeySLHVFONKZAWKET-UHFFFAOYSA-N
XLogP3.15
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.39
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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(1-ethylpyrrolidin-2-yl)-λ2-stannane
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(2-methylpiperidin-1-yl)methanol
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1-(3-bromopropyl)-2-methylpyrrolidine;hydrobromide
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2-[(2R)-2-methylpyrrolidin-1-yl]acetamide
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Frequently Asked Questions

What is the IUPAC name of ethane;1-ethyl-2-methylpyrrolidine;methanol?
The IUPAC name of ethane;1-ethyl-2-methylpyrrolidine;methanol (CID 144741574) is ethane;1-ethyl-2-methylpyrrolidine;methanol.
What is the SMILES notation for ethane;1-ethyl-2-methylpyrrolidine;methanol?
The canonical SMILES for ethane;1-ethyl-2-methylpyrrolidine;methanol is CC.CC.CCN1CCCC1C.CO.
What is the InChIKey of ethane;1-ethyl-2-methylpyrrolidine;methanol?
The InChIKey is SLHVFONKZAWKET-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.2C2H6.CH4O/c1-3-8-6-4-5-7(8)2;3*1-2/h7H,3-6H2,1-2H3;2*1-2H3;2H,1H3.
What are the key properties of ethane;1-ethyl-2-methylpyrrolidine;methanol?
ethane;1-ethyl-2-methylpyrrolidine;methanol has a molecular weight of 205.39 g/mol, XLogP of 3.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethyl-2-methylpyrrolidine;methanol is sourced from PubChem (CID 144741574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).