4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine

C16H22N2O — CID 19366801

IUPAC4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine
SMILESCc1cccc2cc(C)n(CCN3CCOCC3)c12
InChIInChI=1S/C16H22N2O/c1-13-4-3-5-15-12-14(2)18(16(13)15)7-6-17-8-10-19-11-9-17/h3-5,12H,6-11H2,1-2H3
InChIKeyMECVSPKKQPMGPE-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.59
Rot. Bonds3

About 4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine

4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine (PubChem CID 19366801) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine
PubChem CID19366801
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine
SMILESCc1cccc2cc(C)n(CCN3CCOCC3)c12
InChIInChI=1S/C16H22N2O/c1-13-4-3-5-15-12-14(2)18(16(13)15)7-6-17-8-10-19-11-9-17/h3-5,12H,6-11H2,1-2H3
InChIKeyMECVSPKKQPMGPE-UHFFFAOYSA-N
XLogP2.59
TPSA17.40 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine?
The IUPAC name of 4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine (CID 19366801) is 4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine?
The canonical SMILES for 4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine is Cc1cccc2cc(C)n(CCN3CCOCC3)c12.
What is the InChIKey of 4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine?
The InChIKey is MECVSPKKQPMGPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-13-4-3-5-15-12-14(2)18(16(13)15)7-6-17-8-10-19-11-9-17/h3-5,12H,6-11H2,1-2H3.
What are the key properties of 4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine?
4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine has a molecular weight of 258.36 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine is sourced from PubChem (CID 19366801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).