2-(1-ethylcycloheptyl)ethanol

C11H22O — CID 164557788

IUPAC2-(1-ethylcycloheptyl)ethanol
SMILESCCC1(CCO)CCCCCC1
InChIInChI=1S/C11H22O/c1-2-11(9-10-12)7-5-3-4-6-8-11/h12H,2-10H2,1H3
InChIKeyQJALYPNJSWJANU-UHFFFAOYSA-N
MW170.30 g/mol
LogP3.12
Rot. Bonds3

About 2-(1-ethylcycloheptyl)ethanol

2-(1-ethylcycloheptyl)ethanol (PubChem CID 164557788) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is 2-(1-ethylcycloheptyl)ethanol.

Molecular Properties

Compound Name2-(1-ethylcycloheptyl)ethanol
PubChem CID164557788
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Name2-(1-ethylcycloheptyl)ethanol
SMILESCCC1(CCO)CCCCCC1
InChIInChI=1S/C11H22O/c1-2-11(9-10-12)7-5-3-4-6-8-11/h12H,2-10H2,1H3
InChIKeyQJALYPNJSWJANU-UHFFFAOYSA-N
XLogP3.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[1-(2-hydroxyethyl)cyclononadecyl]ethanol
CID 150954870
2-[1-(2-hydroxyethyl)cyclodecyl]ethanol
CID 18618783
(1-ethylcycloheptyl)methanol
CID 56982411
1,1-diethylcyclohexane;ethane
CID 142116480
2-(1-ethylcyclohexyl)-N,N-dimethylethanamine
CID 143122027
1-ethyl-1-propylcyclobutane
CID 58586108
2-[1-[(cyclohexylamino)methyl]cyclohexyl]ethanol
CID 111974878
(1-ethylcyclooctyl)methanamine
CID 80604065
2-[1,2,2-tris(2-hydroxyethyl)cyclononatriacontyl]ethanol
CID 150050079
ethane;1-ethyl-1-(fluoromethyl)cyclohexane
CID 142943476
1-ethyl-1-propylcyclopentane;3-methylbut-3-en-2-one
CID 144910534
[1-[1-(hydroxymethyl)cycloundecyl]cycloundecyl]methanol
CID 22328250

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylcycloheptyl)ethanol?
The IUPAC name of 2-(1-ethylcycloheptyl)ethanol (CID 164557788) is 2-(1-ethylcycloheptyl)ethanol.
What is the SMILES notation for 2-(1-ethylcycloheptyl)ethanol?
The canonical SMILES for 2-(1-ethylcycloheptyl)ethanol is CCC1(CCO)CCCCCC1.
What is the InChIKey of 2-(1-ethylcycloheptyl)ethanol?
The InChIKey is QJALYPNJSWJANU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O/c1-2-11(9-10-12)7-5-3-4-6-8-11/h12H,2-10H2,1H3.
What are the key properties of 2-(1-ethylcycloheptyl)ethanol?
2-(1-ethylcycloheptyl)ethanol has a molecular weight of 170.30 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylcycloheptyl)ethanol is sourced from PubChem (CID 164557788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).