ethane;2-ethylcyclopentan-1-ol

C9H20O — CID 144624771

IUPACethane;2-ethylcyclopentan-1-ol
SMILESCC.CCC1CCCC1O
InChIInChI=1S/C7H14O.C2H6/c1-2-6-4-3-5-7(6)8;1-2/h6-8H,2-5H2,1H3;1-2H3
InChIKeyKCWFJBUNHNUHQL-UHFFFAOYSA-N
MW144.26 g/mol
LogP2.58
Rot. Bonds1

About ethane;2-ethylcyclopentan-1-ol

ethane;2-ethylcyclopentan-1-ol (PubChem CID 144624771) has the molecular formula C9H20O and a molecular weight of 144.26 g/mol. Its IUPAC name is ethane;2-ethylcyclopentan-1-ol.

Molecular Properties

Compound Nameethane;2-ethylcyclopentan-1-ol
PubChem CID144624771
Molecular FormulaC9H20O
Molecular Weight144.26 g/mol
Exact Mass144.15
IUPAC Nameethane;2-ethylcyclopentan-1-ol
SMILESCC.CCC1CCCC1O
InChIInChI=1S/C7H14O.C2H6/c1-2-6-4-3-5-7(6)8;1-2/h6-8H,2-5H2,1H3;1-2H3
InChIKeyKCWFJBUNHNUHQL-UHFFFAOYSA-N
XLogP2.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;2-ethylcyclopentan-1-ol?
The IUPAC name of ethane;2-ethylcyclopentan-1-ol (CID 144624771) is ethane;2-ethylcyclopentan-1-ol.
What is the SMILES notation for ethane;2-ethylcyclopentan-1-ol?
The canonical SMILES for ethane;2-ethylcyclopentan-1-ol is CC.CCC1CCCC1O.
What is the InChIKey of ethane;2-ethylcyclopentan-1-ol?
The InChIKey is KCWFJBUNHNUHQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O.C2H6/c1-2-6-4-3-5-7(6)8;1-2/h6-8H,2-5H2,1H3;1-2H3.
What are the key properties of ethane;2-ethylcyclopentan-1-ol?
ethane;2-ethylcyclopentan-1-ol has a molecular weight of 144.26 g/mol, XLogP of 2.58, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-ethylcyclopentan-1-ol is sourced from PubChem (CID 144624771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).