4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine

C18H23NO2 — CID 3055313

IUPAC4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine
SMILESCOc1ccc2cc(C(C)CN3CCOCC3)ccc2c1
InChIInChI=1S/C18H23NO2/c1-14(13-19-7-9-21-10-8-19)15-3-4-17-12-18(20-2)6-5-16(17)11-15/h3-6,11-12,14H,7-10,13H2,1-2H3
InChIKeyQHRCTPXITIZFMA-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.28
Rot. Bonds4

About 4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine

4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine (PubChem CID 3055313) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is 4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine.

Molecular Properties

Compound Name4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine
PubChem CID3055313
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine
SMILESCOc1ccc2cc(C(C)CN3CCOCC3)ccc2c1
InChIInChI=1S/C18H23NO2/c1-14(13-19-7-9-21-10-8-19)15-3-4-17-12-18(20-2)6-5-16(17)11-15/h3-6,11-12,14H,7-10,13H2,1-2H3
InChIKeyQHRCTPXITIZFMA-UHFFFAOYSA-N
XLogP3.28
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine?
The IUPAC name of 4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine (CID 3055313) is 4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine.
What is the SMILES notation for 4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine?
The canonical SMILES for 4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine is COc1ccc2cc(C(C)CN3CCOCC3)ccc2c1.
What is the InChIKey of 4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine?
The InChIKey is QHRCTPXITIZFMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-14(13-19-7-9-21-10-8-19)15-3-4-17-12-18(20-2)6-5-16(17)11-15/h3-6,11-12,14H,7-10,13H2,1-2H3.
What are the key properties of 4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine?
4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine has a molecular weight of 285.39 g/mol, XLogP of 3.28, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine is sourced from PubChem (CID 3055313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).