(4-butyl-6-ethyl-2-pyridinyl)methanol

C12H19NO — CID 86243510

IUPAC(4-butyl-6-ethyl-2-pyridinyl)methanol
SMILESCCCCc1cc(CC)nc(CO)c1
InChIInChI=1S/C12H19NO/c1-3-5-6-10-7-11(4-2)13-12(8-10)9-14/h7-8,14H,3-6,9H2,1-2H3
InChIKeyMCIQCEZFJPDFTR-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.48
Rot. Bonds5

About (4-butyl-6-ethyl-2-pyridinyl)methanol

(4-butyl-6-ethyl-2-pyridinyl)methanol (PubChem CID 86243510) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is (4-butyl-6-ethyl-2-pyridinyl)methanol.

Molecular Properties

Compound Name(4-butyl-6-ethyl-2-pyridinyl)methanol
PubChem CID86243510
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name(4-butyl-6-ethyl-2-pyridinyl)methanol
SMILESCCCCc1cc(CC)nc(CO)c1
InChIInChI=1S/C12H19NO/c1-3-5-6-10-7-11(4-2)13-12(8-10)9-14/h7-8,14H,3-6,9H2,1-2H3
InChIKeyMCIQCEZFJPDFTR-UHFFFAOYSA-N
XLogP2.48
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-butyl-6-ethyl-2-pyridinyl)methanol?
The IUPAC name of (4-butyl-6-ethyl-2-pyridinyl)methanol (CID 86243510) is (4-butyl-6-ethyl-2-pyridinyl)methanol.
What is the SMILES notation for (4-butyl-6-ethyl-2-pyridinyl)methanol?
The canonical SMILES for (4-butyl-6-ethyl-2-pyridinyl)methanol is CCCCc1cc(CC)nc(CO)c1.
What is the InChIKey of (4-butyl-6-ethyl-2-pyridinyl)methanol?
The InChIKey is MCIQCEZFJPDFTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-3-5-6-10-7-11(4-2)13-12(8-10)9-14/h7-8,14H,3-6,9H2,1-2H3.
What are the key properties of (4-butyl-6-ethyl-2-pyridinyl)methanol?
(4-butyl-6-ethyl-2-pyridinyl)methanol has a molecular weight of 193.29 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-butyl-6-ethyl-2-pyridinyl)methanol is sourced from PubChem (CID 86243510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).