ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine

C10H23NO — CID 177187242

IUPACethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine
SMILESCC.CCC1(CNC)CCCO1
InChIInChI=1S/C8H17NO.C2H6/c1-3-8(7-9-2)5-4-6-10-8;1-2/h9H,3-7H2,1-2H3;1-2H3
InChIKeyHCRZEBOMYCCFJE-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.19
Rot. Bonds3

About ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine

ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine (PubChem CID 177187242) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Nameethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine
PubChem CID177187242
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Nameethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine
SMILESCC.CCC1(CNC)CCCO1
InChIInChI=1S/C8H17NO.C2H6/c1-3-8(7-9-2)5-4-6-10-8;1-2/h9H,3-7H2,1-2H3;1-2H3
InChIKeyHCRZEBOMYCCFJE-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine?
The IUPAC name of ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine (CID 177187242) is ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine.
What is the SMILES notation for ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine?
The canonical SMILES for ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine is CC.CCC1(CNC)CCCO1.
What is the InChIKey of ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine?
The InChIKey is HCRZEBOMYCCFJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.C2H6/c1-3-8(7-9-2)5-4-6-10-8;1-2/h9H,3-7H2,1-2H3;1-2H3.
What are the key properties of ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine?
ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine has a molecular weight of 173.30 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(2-ethyloxolan-2-yl)-N-methylmethanamine is sourced from PubChem (CID 177187242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).