4-(3-pyrrol-1-ylpropyl)morpholine

C11H18N2O — CID 43394749

IUPAC4-(3-pyrrol-1-ylpropyl)morpholine
SMILESc1ccn(CCCN2CCOCC2)c1
InChIInChI=1S/C11H18N2O/c1-2-5-12(4-1)6-3-7-13-8-10-14-11-9-13/h1-2,4-5H,3,6-11H2
InChIKeyUXBUEEJRFRQQKL-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.21
Rot. Bonds4

About 4-(3-pyrrol-1-ylpropyl)morpholine

4-(3-pyrrol-1-ylpropyl)morpholine (PubChem CID 43394749) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 4-(3-pyrrol-1-ylpropyl)morpholine.

Molecular Properties

Compound Name4-(3-pyrrol-1-ylpropyl)morpholine
PubChem CID43394749
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name4-(3-pyrrol-1-ylpropyl)morpholine
SMILESc1ccn(CCCN2CCOCC2)c1
InChIInChI=1S/C11H18N2O/c1-2-5-12(4-1)6-3-7-13-8-10-14-11-9-13/h1-2,4-5H,3,6-11H2
InChIKeyUXBUEEJRFRQQKL-UHFFFAOYSA-N
XLogP1.21
TPSA17.40 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-pyrrol-1-ylpropyl)morpholine?
The IUPAC name of 4-(3-pyrrol-1-ylpropyl)morpholine (CID 43394749) is 4-(3-pyrrol-1-ylpropyl)morpholine.
What is the SMILES notation for 4-(3-pyrrol-1-ylpropyl)morpholine?
The canonical SMILES for 4-(3-pyrrol-1-ylpropyl)morpholine is c1ccn(CCCN2CCOCC2)c1.
What is the InChIKey of 4-(3-pyrrol-1-ylpropyl)morpholine?
The InChIKey is UXBUEEJRFRQQKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-2-5-12(4-1)6-3-7-13-8-10-14-11-9-13/h1-2,4-5H,3,6-11H2.
What are the key properties of 4-(3-pyrrol-1-ylpropyl)morpholine?
4-(3-pyrrol-1-ylpropyl)morpholine has a molecular weight of 194.28 g/mol, XLogP of 1.21, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-pyrrol-1-ylpropyl)morpholine is sourced from PubChem (CID 43394749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).