1-(6-ethyl-3-pyridinyl)ethanol

C9H13NO — CID 88974864

IUPAC1-(6-ethyl-3-pyridinyl)ethanol
SMILESCCc1ccc(C(C)O)cn1
InChIInChI=1S/C9H13NO/c1-3-9-5-4-8(6-10-9)7(2)11/h4-7,11H,3H2,1-2H3
InChIKeyKHDPSJWEOAOJPL-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.70
Rot. Bonds2

About 1-(6-ethyl-3-pyridinyl)ethanol

1-(6-ethyl-3-pyridinyl)ethanol (PubChem CID 88974864) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 1-(6-ethyl-3-pyridinyl)ethanol.

Molecular Properties

Compound Name1-(6-ethyl-3-pyridinyl)ethanol
PubChem CID88974864
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name1-(6-ethyl-3-pyridinyl)ethanol
SMILESCCc1ccc(C(C)O)cn1
InChIInChI=1S/C9H13NO/c1-3-9-5-4-8(6-10-9)7(2)11/h4-7,11H,3H2,1-2H3
InChIKeyKHDPSJWEOAOJPL-UHFFFAOYSA-N
XLogP1.70
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(6-ethyl-3-pyridinyl)ethanol?
The IUPAC name of 1-(6-ethyl-3-pyridinyl)ethanol (CID 88974864) is 1-(6-ethyl-3-pyridinyl)ethanol.
What is the SMILES notation for 1-(6-ethyl-3-pyridinyl)ethanol?
The canonical SMILES for 1-(6-ethyl-3-pyridinyl)ethanol is CCc1ccc(C(C)O)cn1.
What is the InChIKey of 1-(6-ethyl-3-pyridinyl)ethanol?
The InChIKey is KHDPSJWEOAOJPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-3-9-5-4-8(6-10-9)7(2)11/h4-7,11H,3H2,1-2H3.
What are the key properties of 1-(6-ethyl-3-pyridinyl)ethanol?
1-(6-ethyl-3-pyridinyl)ethanol has a molecular weight of 151.21 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-ethyl-3-pyridinyl)ethanol is sourced from PubChem (CID 88974864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).