2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene

C23H26O3 — CID 156596309

IUPAC2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene
SMILESCOc1ccc(CCCOC(C)c2ccc3cc(OC)ccc3c2)cc1
InChIInChI=1S/C23H26O3/c1-17(26-14-4-5-18-6-11-22(24-2)12-7-18)19-8-9-21-16-23(25-3)13-10-20(21)15-19/h6-13,15-17H,4-5,14H2,1-3H3
InChIKeyMZPFOOSMMKXVNC-UHFFFAOYSA-N
MW350.46 g/mol
LogP5.57
Rot. Bonds8

About 2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene

2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene (PubChem CID 156596309) has the molecular formula C23H26O3 and a molecular weight of 350.46 g/mol. Its IUPAC name is 2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene.

Molecular Properties

Compound Name2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene
PubChem CID156596309
Molecular FormulaC23H26O3
Molecular Weight350.46 g/mol
Exact Mass350.19
IUPAC Name2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene
SMILESCOc1ccc(CCCOC(C)c2ccc3cc(OC)ccc3c2)cc1
InChIInChI=1S/C23H26O3/c1-17(26-14-4-5-18-6-11-22(24-2)12-7-18)19-8-9-21-16-23(25-3)13-10-20(21)15-19/h6-13,15-17H,4-5,14H2,1-3H3
InChIKeyMZPFOOSMMKXVNC-UHFFFAOYSA-N
XLogP5.57
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.46
LogP ≤ 55.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[(1S)-1-butoxyethyl]-4-methoxybenzene
CID 102525034
1-[1-(3-chloropropoxy)ethyl]-4-methoxybenzene
CID 86112435
triethyl-[4-[1-(6-methoxynaphthalen-2-yl)ethoxy]but-1-ynyl]silane
CID 156596313
1-(6-methoxynaphthalen-2-yl)-3-(4-methylphenyl)propan-1-ol
CID 102441860
(2S)-2-(6-methoxynaphthalen-2-yl)propan-1-amine
CID 93286235
N,N'-bis[1-(6-methoxynaphthalen-2-yl)ethyl]ethane-1,2-diamine
CID 23154308
2-methoxyethyl (2R)-2-(6-methoxynaphthalen-2-yl)propanoate
CID 101261822
1-methoxybutane;2-propan-2-yl-6-[3-(6-propylnaphthalen-2-yl)oxypropyl]naphthalene
CID 143968515
6-(4-methoxyphenyl)-2-methylhexan-3-amine
CID 83932077
1-methoxy-4-(4-methoxybutyl)benzene
CID 18345059
N-ethyl-1-(6-methoxynaphthalen-2-yl)ethanamine
CID 24708514
CID 140788686
CID 140788686

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene?
The IUPAC name of 2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene (CID 156596309) is 2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene.
What is the SMILES notation for 2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene?
The canonical SMILES for 2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene is COc1ccc(CCCOC(C)c2ccc3cc(OC)ccc3c2)cc1.
What is the InChIKey of 2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene?
The InChIKey is MZPFOOSMMKXVNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26O3/c1-17(26-14-4-5-18-6-11-22(24-2)12-7-18)19-8-9-21-16-23(25-3)13-10-20(21)15-19/h6-13,15-17H,4-5,14H2,1-3H3.
What are the key properties of 2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene?
2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene has a molecular weight of 350.46 g/mol, XLogP of 5.57, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-[1-[3-(4-methoxyphenyl)propoxy]ethyl]naphthalene is sourced from PubChem (CID 156596309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).