2-(3H-inden-4-yloxymethyl)morpholine

C14H17NO2 — CID 3704

💊View drug profile → indeloxazine
IUPAC2-(3H-inden-4-yloxymethyl)morpholine
SMILESC1=Cc2cccc(OCC3CNCCO3)c2C1
InChIInChI=1S/C14H17NO2/c1-3-11-4-2-6-14(13(11)5-1)17-10-12-9-15-7-8-16-12/h1-4,6,12,15H,5,7-10H2
InChIKeyMADRVGBADLFHMO-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.62
Rot. Bonds3

About 2-(3H-inden-4-yloxymethyl)morpholine

2-(3H-inden-4-yloxymethyl)morpholine (PubChem CID 3704) has the molecular formula C14H17NO2 and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-(3H-inden-4-yloxymethyl)morpholine.

Molecular Properties

Compound Name2-(3H-inden-4-yloxymethyl)morpholine
PubChem CID3704
Molecular FormulaC14H17NO2
Molecular Weight231.30 g/mol
Exact Mass231.13
IUPAC Name2-(3H-inden-4-yloxymethyl)morpholine
SMILESC1=Cc2cccc(OCC3CNCCO3)c2C1
InChIInChI=1S/C14H17NO2/c1-3-11-4-2-6-14(13(11)5-1)17-10-12-9-15-7-8-16-12/h1-4,6,12,15H,5,7-10H2
InChIKeyMADRVGBADLFHMO-UHFFFAOYSA-N
XLogP1.62
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Alprenolol
CID 2119
Propranolol
CID 4946
Propranolol Hydrochloride
CID 62882
Dexpropranolol Hydrochloride
CID 66366
Dexpropranolol
CID 21138
Levopropranolol
CID 91536
Ici-118551
CID 5484725
Alprenolol, (S)-
CID 204665
Lubazodone Hydrochloride
CID 157918
rac-(2R,3R)-1-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxy]-3-[(propan-2-yl)amino]butan-2-ol
CID 5311179
Levopropranolol hydrochloride
CID 165193
2-Propanol, 1-((1-methylethyl)amino)-3-(2-(2-propenyl)phenoxy)-, (R)-
CID 203685

Frequently Asked Questions

What is the IUPAC name of 2-(3H-inden-4-yloxymethyl)morpholine?
The IUPAC name of 2-(3H-inden-4-yloxymethyl)morpholine (CID 3704) is 2-(3H-inden-4-yloxymethyl)morpholine.
What is the SMILES notation for 2-(3H-inden-4-yloxymethyl)morpholine?
The canonical SMILES for 2-(3H-inden-4-yloxymethyl)morpholine is C1=Cc2cccc(OCC3CNCCO3)c2C1.
What is the InChIKey of 2-(3H-inden-4-yloxymethyl)morpholine?
The InChIKey is MADRVGBADLFHMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-3-11-4-2-6-14(13(11)5-1)17-10-12-9-15-7-8-16-12/h1-4,6,12,15H,5,7-10H2.
What are the key properties of 2-(3H-inden-4-yloxymethyl)morpholine?
2-(3H-inden-4-yloxymethyl)morpholine has a molecular weight of 231.30 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3H-inden-4-yloxymethyl)morpholine is sourced from PubChem (CID 3704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).