4'-ethoxyspiro[cyclopentane-1,1'-indene]

C15H18O — CID 123667058

IUPAC4'-ethoxyspiro[cyclopentane-1,1'-indene]
SMILESCCOc1cccc2c1C=CC21CCCC1
InChIInChI=1S/C15H18O/c1-2-16-14-7-5-6-13-12(14)8-11-15(13)9-3-4-10-15/h5-8,11H,2-4,9-10H2,1H3
InChIKeyHXVIOSTVKIUYLO-UHFFFAOYSA-N
MW214.31 g/mol
LogP3.92
Rot. Bonds2

About 4'-ethoxyspiro[cyclopentane-1,1'-indene]

4'-ethoxyspiro[cyclopentane-1,1'-indene] (PubChem CID 123667058) has the molecular formula C15H18O and a molecular weight of 214.31 g/mol. Its IUPAC name is 4'-ethoxyspiro[cyclopentane-1,1'-indene].

Molecular Properties

Compound Name4'-ethoxyspiro[cyclopentane-1,1'-indene]
PubChem CID123667058
Molecular FormulaC15H18O
Molecular Weight214.31 g/mol
Exact Mass214.14
IUPAC Name4'-ethoxyspiro[cyclopentane-1,1'-indene]
SMILESCCOc1cccc2c1C=CC21CCCC1
InChIInChI=1S/C15H18O/c1-2-16-14-7-5-6-13-12(14)8-11-15(13)9-3-4-10-15/h5-8,11H,2-4,9-10H2,1H3
InChIKeyHXVIOSTVKIUYLO-UHFFFAOYSA-N
XLogP3.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-ethoxyphenyl)cycloheptan-1-ol
CID 55120332
4-methoxyspiro[indene-1,3'-oxolane]
CID 118314490
1-(2-ethoxy-3-methoxyphenyl)cyclopentan-1-amine
CID 117342977
2-(1-aminocyclopentyl)-3-ethoxyphenol
CID 117316542
4',7'-dimethoxyspiro[cyclopentane-1,1'-indene]
CID 118314361
[1-(2-ethoxyphenyl)cyclopropyl]methanol
CID 105425266
5-(2-ethoxyphenyl)-6,7,8,9-tetrahydrobenzo[7]annulen-5-amine
CID 62802871
[1-(dimethylamino)cyclopentyl]-(2-ethoxyphenyl)methanol
CID 79067542
1-[(3,4-diethoxyphenyl)-hydroxymethyl]cyclopentan-1-ol
CID 103448377
1-[2-(2-ethoxyphenoxy)ethyl]cyclooctan-1-amine
CID 80610107
1-(3-ethoxy-2-methoxyphenyl)cyclopropane-1-carbaldehyde
CID 105475572
3-(2-ethoxyphenyl)-3-methylcyclopentan-1-ol
CID 116540045

Frequently Asked Questions

What is the IUPAC name of 4'-ethoxyspiro[cyclopentane-1,1'-indene]?
The IUPAC name of 4'-ethoxyspiro[cyclopentane-1,1'-indene] (CID 123667058) is 4'-ethoxyspiro[cyclopentane-1,1'-indene].
What is the SMILES notation for 4'-ethoxyspiro[cyclopentane-1,1'-indene]?
The canonical SMILES for 4'-ethoxyspiro[cyclopentane-1,1'-indene] is CCOc1cccc2c1C=CC21CCCC1.
What is the InChIKey of 4'-ethoxyspiro[cyclopentane-1,1'-indene]?
The InChIKey is HXVIOSTVKIUYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O/c1-2-16-14-7-5-6-13-12(14)8-11-15(13)9-3-4-10-15/h5-8,11H,2-4,9-10H2,1H3.
What are the key properties of 4'-ethoxyspiro[cyclopentane-1,1'-indene]?
4'-ethoxyspiro[cyclopentane-1,1'-indene] has a molecular weight of 214.31 g/mol, XLogP of 3.92, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4'-ethoxyspiro[cyclopentane-1,1'-indene] is sourced from PubChem (CID 123667058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).