ethane;2-(ethoxymethyl)-1-methylpyrrolidine

C10H23NO — CID 169145954

IUPACethane;2-(ethoxymethyl)-1-methylpyrrolidine
SMILESCC.CCOCC1CCCN1C
InChIInChI=1S/C8H17NO.C2H6/c1-3-10-7-8-5-4-6-9(8)2;1-2/h8H,3-7H2,1-2H3;1-2H3
InChIKeyKZTOGFAABSLKIP-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.14
Rot. Bonds3

About ethane;2-(ethoxymethyl)-1-methylpyrrolidine

ethane;2-(ethoxymethyl)-1-methylpyrrolidine (PubChem CID 169145954) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is ethane;2-(ethoxymethyl)-1-methylpyrrolidine.

Molecular Properties

Compound Nameethane;2-(ethoxymethyl)-1-methylpyrrolidine
PubChem CID169145954
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Nameethane;2-(ethoxymethyl)-1-methylpyrrolidine
SMILESCC.CCOCC1CCCN1C
InChIInChI=1S/C8H17NO.C2H6/c1-3-10-7-8-5-4-6-9(8)2;1-2/h8H,3-7H2,1-2H3;1-2H3
InChIKeyKZTOGFAABSLKIP-UHFFFAOYSA-N
XLogP2.14
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diethyl-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]ethanamine
CID 121001602
2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]ethanamine
CID 54091404
[(2S)-1-methylpyrrolidin-2-yl]methyl hypoiodite
CID 149141238
(1-methylpyrrolidin-2-yl)methyl formate
CID 54245188
2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol
CID 129495167
(2R)-2-ethyl-1-methylpyrrolidine;hydrofluoride
CID 162730747
3-[(1-methylpyrrolidin-2-yl)methoxy]propanoic acid
CID 83817688
ethane;8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine;1-methyl-2-(propan-2-yloxymethyl)pyrrolidine
CID 169146065
[(2R)-1-methylpyrrolidin-2-yl]methyl methanesulfonate
CID 58483914
1-(2-ethoxyethyl)-2-(ethoxymethyl)piperidine
CID 121012447
4-[(1-methylpiperidin-2-yl)methoxy]butan-1-amine
CID 65469045
2-[[(2R)-1-methylpiperidin-2-yl]methoxy]acetic acid
CID 92669710

Frequently Asked Questions

What is the IUPAC name of ethane;2-(ethoxymethyl)-1-methylpyrrolidine?
The IUPAC name of ethane;2-(ethoxymethyl)-1-methylpyrrolidine (CID 169145954) is ethane;2-(ethoxymethyl)-1-methylpyrrolidine.
What is the SMILES notation for ethane;2-(ethoxymethyl)-1-methylpyrrolidine?
The canonical SMILES for ethane;2-(ethoxymethyl)-1-methylpyrrolidine is CC.CCOCC1CCCN1C.
What is the InChIKey of ethane;2-(ethoxymethyl)-1-methylpyrrolidine?
The InChIKey is KZTOGFAABSLKIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.C2H6/c1-3-10-7-8-5-4-6-9(8)2;1-2/h8H,3-7H2,1-2H3;1-2H3.
What are the key properties of ethane;2-(ethoxymethyl)-1-methylpyrrolidine?
ethane;2-(ethoxymethyl)-1-methylpyrrolidine has a molecular weight of 173.30 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(ethoxymethyl)-1-methylpyrrolidine is sourced from PubChem (CID 169145954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).