2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde

C24H30O3 — CID 22634644

IUPAC2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde
SMILESCOCOc1ccc(-c2cc3c(cc2C)C(C)(C)CCC3(C)C)cc1C=O
InChIInChI=1S/C24H30O3/c1-16-11-20-21(24(4,5)10-9-23(20,2)3)13-19(16)17-7-8-22(27-15-26-6)18(12-17)14-25/h7-8,11-14H,9-10,15H2,1-6H3
InChIKeyOKGWTLPLWPGDMA-UHFFFAOYSA-N
MW366.50 g/mol
LogP5.81
Rot. Bonds5

About 2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde

2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde (PubChem CID 22634644) has the molecular formula C24H30O3 and a molecular weight of 366.50 g/mol. Its IUPAC name is 2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde.

Molecular Properties

Compound Name2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde
PubChem CID22634644
Molecular FormulaC24H30O3
Molecular Weight366.50 g/mol
Exact Mass366.22
IUPAC Name2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde
SMILESCOCOc1ccc(-c2cc3c(cc2C)C(C)(C)CCC3(C)C)cc1C=O
InChIInChI=1S/C24H30O3/c1-16-11-20-21(24(4,5)10-9-23(20,2)3)13-19(16)17-7-8-22(27-15-26-6)18(12-17)14-25/h7-8,11-14H,9-10,15H2,1-6H3
InChIKeyOKGWTLPLWPGDMA-UHFFFAOYSA-N
XLogP5.81
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.50
LogP ≤ 55.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde?
The IUPAC name of 2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde (CID 22634644) is 2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde.
What is the SMILES notation for 2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde?
The canonical SMILES for 2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde is COCOc1ccc(-c2cc3c(cc2C)C(C)(C)CCC3(C)C)cc1C=O.
What is the InChIKey of 2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde?
The InChIKey is OKGWTLPLWPGDMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30O3/c1-16-11-20-21(24(4,5)10-9-23(20,2)3)13-19(16)17-7-8-22(27-15-26-6)18(12-17)14-25/h7-8,11-14H,9-10,15H2,1-6H3.
What are the key properties of 2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde?
2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde has a molecular weight of 366.50 g/mol, XLogP of 5.81, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethoxy)-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)benzaldehyde is sourced from PubChem (CID 22634644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).