(1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane

C8H14O — CID 89065907

IUPAC(1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane
SMILESCCO[C@@H]1[C@H](C)C12CC2
InChIInChI=1S/C8H14O/c1-3-9-7-6(2)8(7)4-5-8/h6-7H,3-5H2,1-2H3/t6-,7+/m0/s1
InChIKeyVYMZHQZALDAZLQ-NKWVEPMBSA-N
MW126.20 g/mol
LogP1.82
Rot. Bonds2

About (1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane

(1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane (PubChem CID 89065907) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is (1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane.

Molecular Properties

Compound Name(1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane
PubChem CID89065907
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name(1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane
SMILESCCO[C@@H]1[C@H](C)C12CC2
InChIInChI=1S/C8H14O/c1-3-9-7-6(2)8(7)4-5-8/h6-7H,3-5H2,1-2H3/t6-,7+/m0/s1
InChIKeyVYMZHQZALDAZLQ-NKWVEPMBSA-N
XLogP1.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(1R,2S,3S)-1-chloro-2-ethoxy-1-fluoro-3-methylcyclopropane
CID 97289325
azane;ethoxycyclooctane
CID 70271275
ethane;1-ethoxy-4-methylcyclohexane
CID 145107105
2-(2-azaspiro[3.4]octan-2-yl)-3-ethoxycyclobutan-1-amine
CID 79677703
2-(2-azaspiro[3.3]heptan-2-yl)-3-ethoxycyclobutan-1-amine
CID 79677954
3-ethoxy-2,2,7,7-tetramethylbicyclo[2.2.1]heptane
CID 70370724
(1R,3S)-3-ethoxyspiro[3.4]octan-1-amine
CID 95566836
ethoxycyclooctane
CID 13427982
sodium 4-ethoxy-1-hydroxycyclohexane-1-sulfonate
CID 164651326
3-bromo-1-ethoxyspiro[3.4]octane
CID 66346132
3-ethoxy-N-(2-methylcyclopropyl)spiro[3.3]heptan-1-amine
CID 65294430
ethane;1-ethoxy-3-methylcyclobutane
CID 169190771

Frequently Asked Questions

What is the IUPAC name of (1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane?
The IUPAC name of (1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane (CID 89065907) is (1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane.
What is the SMILES notation for (1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane?
The canonical SMILES for (1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane is CCO[C@@H]1[C@H](C)C12CC2.
What is the InChIKey of (1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane?
The InChIKey is VYMZHQZALDAZLQ-NKWVEPMBSA-N. The full InChI is InChI=1S/C8H14O/c1-3-9-7-6(2)8(7)4-5-8/h6-7H,3-5H2,1-2H3/t6-,7+/m0/s1.
What are the key properties of (1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane?
(1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane has a molecular weight of 126.20 g/mol, XLogP of 1.82, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-2-ethoxy-1-methylspiro[2.2]pentane is sourced from PubChem (CID 89065907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).