4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium

C16H20NO2+ — CID 7074084

IUPAC4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium
SMILESc1ccc2c(OCC[NH+]3CCOCC3)cccc2c1
InChIInChI=1S/C16H19NO2/c1-2-6-15-14(4-1)5-3-7-16(15)19-13-10-17-8-11-18-12-9-17/h1-7H,8-13H2/p+1
InChIKeyRGGDCOHLQXIUIA-UHFFFAOYSA-O
MW258.34 g/mol
LogP1.13
Rot. Bonds4

About 4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium

4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium (PubChem CID 7074084) has the molecular formula C16H20NO2+ and a molecular weight of 258.34 g/mol. Its IUPAC name is 4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium.

Molecular Properties

Compound Name4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium
PubChem CID7074084
Molecular FormulaC16H20NO2+
Molecular Weight258.34 g/mol
Exact Mass258.15
IUPAC Name4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium
SMILESc1ccc2c(OCC[NH+]3CCOCC3)cccc2c1
InChIInChI=1S/C16H19NO2/c1-2-6-15-14(4-1)5-3-7-16(15)19-13-10-17-8-11-18-12-9-17/h1-7H,8-13H2/p+1
InChIKeyRGGDCOHLQXIUIA-UHFFFAOYSA-O
XLogP1.13
TPSA22.90 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.34
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-naphthalen-1-yloxypropyl)pyrrolidin-1-ium
CID 2237951
4-[2-(2-phenylmethoxyphenoxy)ethyl]morpholin-4-ium
CID 7379859
1-(4-naphthalen-1-yloxybutyl)piperidin-1-ium
CID 2057909
(3S,5S)-3,5-dimethyl-1-(2-naphthalen-1-yloxyethyl)piperidin-1-ium
CID 7377440
4-[2-[2-[(2R)-butan-2-yl]phenoxy]ethyl]morpholin-4-ium
CID 7381404
4-(naphthalen-1-ylmethyl)morpholin-4-ium
CID 6942888
4-[2-(4-benzylphenoxy)ethyl]morpholin-4-ium
CID 7380149
oxirane;1-prop-2-enoxynaphthalene
CID 174790954
4-[2-(2-chloro-5-methylphenoxy)ethyl]morpholin-4-ium
CID 7460466
1-(3-chloropropoxy)naphthalene
CID 12685615
(3R,5R)-3,5-dimethyl-1-[2-(2-naphthalen-1-yloxyethoxy)ethyl]piperidin-1-ium
CID 7411201
4-[2-(4-chloro-2-methylphenoxy)ethyl]morpholin-4-ium
CID 7460476

Frequently Asked Questions

What is the IUPAC name of 4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium?
The IUPAC name of 4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium (CID 7074084) is 4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium.
What is the SMILES notation for 4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium?
The canonical SMILES for 4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium is c1ccc2c(OCC[NH+]3CCOCC3)cccc2c1.
What is the InChIKey of 4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium?
The InChIKey is RGGDCOHLQXIUIA-UHFFFAOYSA-O. The full InChI is InChI=1S/C16H19NO2/c1-2-6-15-14(4-1)5-3-7-16(15)19-13-10-17-8-11-18-12-9-17/h1-7H,8-13H2/p+1.
What are the key properties of 4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium?
4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium has a molecular weight of 258.34 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium is sourced from PubChem (CID 7074084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).