(2-ethyl-3-pyridinyl)methanol

C8H11NO — CID 19690951

IUPAC(2-ethyl-3-pyridinyl)methanol
SMILESCCc1ncccc1CO
InChIInChI=1S/C8H11NO/c1-2-8-7(6-10)4-3-5-9-8/h3-5,10H,2,6H2,1H3
InChIKeyDTEHAOWFPTWQFH-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.14
Rot. Bonds2

About (2-ethyl-3-pyridinyl)methanol

(2-ethyl-3-pyridinyl)methanol (PubChem CID 19690951) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is (2-ethyl-3-pyridinyl)methanol.

Molecular Properties

Compound Name(2-ethyl-3-pyridinyl)methanol
PubChem CID19690951
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name(2-ethyl-3-pyridinyl)methanol
SMILESCCc1ncccc1CO
InChIInChI=1S/C8H11NO/c1-2-8-7(6-10)4-3-5-9-8/h3-5,10H,2,6H2,1H3
InChIKeyDTEHAOWFPTWQFH-UHFFFAOYSA-N
XLogP1.14
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-ethyl-3-pyridinyl)methanol?
The IUPAC name of (2-ethyl-3-pyridinyl)methanol (CID 19690951) is (2-ethyl-3-pyridinyl)methanol.
What is the SMILES notation for (2-ethyl-3-pyridinyl)methanol?
The canonical SMILES for (2-ethyl-3-pyridinyl)methanol is CCc1ncccc1CO.
What is the InChIKey of (2-ethyl-3-pyridinyl)methanol?
The InChIKey is DTEHAOWFPTWQFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-2-8-7(6-10)4-3-5-9-8/h3-5,10H,2,6H2,1H3.
What are the key properties of (2-ethyl-3-pyridinyl)methanol?
(2-ethyl-3-pyridinyl)methanol has a molecular weight of 137.18 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-3-pyridinyl)methanol is sourced from PubChem (CID 19690951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).