1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol

C10H20O2 — CID 130713079

IUPAC1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol
SMILESCCOC1CC(C(C)O)C1(C)C
InChIInChI=1S/C10H20O2/c1-5-12-9-6-8(7(2)11)10(9,3)4/h7-9,11H,5-6H2,1-4H3
InChIKeyGZRZHURMQGYELM-UHFFFAOYSA-N
MW172.27 g/mol
LogP1.82
Rot. Bonds3

About 1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol

1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol (PubChem CID 130713079) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol.

Molecular Properties

Compound Name1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol
PubChem CID130713079
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol
SMILESCCOC1CC(C(C)O)C1(C)C
InChIInChI=1S/C10H20O2/c1-5-12-9-6-8(7(2)11)10(9,3)4/h7-9,11H,5-6H2,1-4H3
InChIKeyGZRZHURMQGYELM-UHFFFAOYSA-N
XLogP1.82
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1S,3R)-3-ethoxy-2,2-dimethylcyclobutan-1-ol
CID 95240890
bis(3-ethoxy-2,2-dimethylcyclobutyl) hexanedioate
CID 154165375
3-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)-N-methylbutanamide;hydrochloride
CID 119799255
ethyl 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanoate
CID 64688546
2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-4-methylpentanoic acid
CID 64853101
2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-methylpropanamide
CID 64851351
2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide
CID 64688946
N-(3,3-diethoxypropyl)-3-ethoxy-2,2-dimethylcyclobutan-1-amine
CID 102977010
3-ethoxy-2,2-dimethyl-N-(2-propan-2-yloxyethyl)cyclobutan-1-amine
CID 104584738
2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide
CID 115641518
N-cyclopropyl-2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide
CID 112696347
4-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-methylbutanamide
CID 114119108

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol?
The IUPAC name of 1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol (CID 130713079) is 1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol.
What is the SMILES notation for 1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol?
The canonical SMILES for 1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol is CCOC1CC(C(C)O)C1(C)C.
What is the InChIKey of 1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol?
The InChIKey is GZRZHURMQGYELM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-5-12-9-6-8(7(2)11)10(9,3)4/h7-9,11H,5-6H2,1-4H3.
What are the key properties of 1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol?
1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol has a molecular weight of 172.27 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxy-2,2-dimethylcyclobutyl)ethanol is sourced from PubChem (CID 130713079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).