4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine

C15H22N2O — CID 115105401

IUPAC4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine
SMILESc1cc(CCCN2CCOCC2)c2c(c1)CCN2
InChIInChI=1S/C15H22N2O/c1-3-13(15-14(4-1)6-7-16-15)5-2-8-17-9-11-18-12-10-17/h1,3-4,16H,2,5-12H2
InChIKeyWZHJNFRJPBYPLU-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.92
Rot. Bonds4

About 4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine

4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine (PubChem CID 115105401) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine.

Molecular Properties

Compound Name4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine
PubChem CID115105401
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine
SMILESc1cc(CCCN2CCOCC2)c2c(c1)CCN2
InChIInChI=1S/C15H22N2O/c1-3-13(15-14(4-1)6-7-16-15)5-2-8-17-9-11-18-12-10-17/h1,3-4,16H,2,5-12H2
InChIKeyWZHJNFRJPBYPLU-UHFFFAOYSA-N
XLogP1.92
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine?
The IUPAC name of 4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine (CID 115105401) is 4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine.
What is the SMILES notation for 4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine?
The canonical SMILES for 4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine is c1cc(CCCN2CCOCC2)c2c(c1)CCN2.
What is the InChIKey of 4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine?
The InChIKey is WZHJNFRJPBYPLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-3-13(15-14(4-1)6-7-16-15)5-2-8-17-9-11-18-12-10-17/h1,3-4,16H,2,5-12H2.
What are the key properties of 4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine?
4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine has a molecular weight of 246.35 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(2,3-dihydro-1H-indol-7-yl)propyl]morpholine is sourced from PubChem (CID 115105401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).