3-(2-methylpropyl)morpholine

C8H17NO — CID 20811826

IUPAC3-(2-methylpropyl)morpholine
SMILESCC(C)CC1COCCN1
InChIInChI=1S/C8H17NO/c1-7(2)5-8-6-10-4-3-9-8/h7-9H,3-6H2,1-2H3
InChIKeyINIRYZSIQPENMR-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.02
Rot. Bonds2

About 3-(2-methylpropyl)morpholine

3-(2-methylpropyl)morpholine (PubChem CID 20811826) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 3-(2-methylpropyl)morpholine.

Molecular Properties

Compound Name3-(2-methylpropyl)morpholine
PubChem CID20811826
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name3-(2-methylpropyl)morpholine
SMILESCC(C)CC1COCCN1
InChIInChI=1S/C8H17NO/c1-7(2)5-8-6-10-4-3-9-8/h7-9H,3-6H2,1-2H3
InChIKeyINIRYZSIQPENMR-UHFFFAOYSA-N
XLogP1.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpropyl)morpholine?
The IUPAC name of 3-(2-methylpropyl)morpholine (CID 20811826) is 3-(2-methylpropyl)morpholine.
What is the SMILES notation for 3-(2-methylpropyl)morpholine?
The canonical SMILES for 3-(2-methylpropyl)morpholine is CC(C)CC1COCCN1.
What is the InChIKey of 3-(2-methylpropyl)morpholine?
The InChIKey is INIRYZSIQPENMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-7(2)5-8-6-10-4-3-9-8/h7-9H,3-6H2,1-2H3.
What are the key properties of 3-(2-methylpropyl)morpholine?
3-(2-methylpropyl)morpholine has a molecular weight of 143.23 g/mol, XLogP of 1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpropyl)morpholine is sourced from PubChem (CID 20811826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).