2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene

C14H20O2 — CID 144633742

IUPAC2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene
SMILESCCOC1(OC)Cc2c(C)ccc(C)c2C1
InChIInChI=1S/C14H20O2/c1-5-16-14(15-4)8-12-10(2)6-7-11(3)13(12)9-14/h6-7H,5,8-9H2,1-4H3
InChIKeyMPIGDLPWQFDORD-UHFFFAOYSA-N
MW220.31 g/mol
LogP2.78
Rot. Bonds3

About 2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene

2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene (PubChem CID 144633742) has the molecular formula C14H20O2 and a molecular weight of 220.31 g/mol. Its IUPAC name is 2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene.

Molecular Properties

Compound Name2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene
PubChem CID144633742
Molecular FormulaC14H20O2
Molecular Weight220.31 g/mol
Exact Mass220.15
IUPAC Name2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene
SMILESCCOC1(OC)Cc2c(C)ccc(C)c2C1
InChIInChI=1S/C14H20O2/c1-5-16-14(15-4)8-12-10(2)6-7-11(3)13(12)9-14/h6-7H,5,8-9H2,1-4H3
InChIKeyMPIGDLPWQFDORD-UHFFFAOYSA-N
XLogP2.78
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethyl 2-amino-4-fluoro-7-methyl-1,3-dihydroindene-2-carboxylate
CID 91348519
ethane;4-methoxy-7-methylspiro[1,3-dihydroindene-2,1'-cyclopropane]
CID 144506452
4-ethoxy-1-(4-fluorophenyl)-4-methoxycyclohexane-1-carbaldehyde
CID 143594619
1,1-diethoxycyclopropane;sulfane
CID 175457696
ethyl 4-methyl-5,6,7,8-tetrahydronaphthalene-1-carboxylate
CID 24974859
ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol
CID 144506413
[(1R,2S)-2-chloro-1-ethoxycyclopropyl]benzene
CID 130756421
ethyl 2-amino-4,7-dimethoxy-1,3-dihydroindene-2-carboxylate
CID 91306842
1,1,3,3-tetraethoxycyclohexane
CID 151917056
ethyl 2,5,8-trimethyl-3,4-dihydrochromene-2-carboxylate
CID 102113586
(3-chloro-4-methylphenyl)-(4-ethoxyoxan-4-yl)methanone
CID 107559961
5-ethoxy-5-methoxy-2-(4-methoxyphenyl)-3-methylcyclopent-2-en-1-one
CID 177422403

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene?
The IUPAC name of 2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene (CID 144633742) is 2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene.
What is the SMILES notation for 2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene?
The canonical SMILES for 2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene is CCOC1(OC)Cc2c(C)ccc(C)c2C1.
What is the InChIKey of 2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene?
The InChIKey is MPIGDLPWQFDORD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O2/c1-5-16-14(15-4)8-12-10(2)6-7-11(3)13(12)9-14/h6-7H,5,8-9H2,1-4H3.
What are the key properties of 2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene?
2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene has a molecular weight of 220.31 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-methoxy-4,7-dimethyl-1,3-dihydroindene is sourced from PubChem (CID 144633742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).