(1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol

C15H23NO2 — CID 116753621

IUPAC(1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol
SMILESCCOC1(C(O)c2cncc(C)c2)CCCCC1
InChIInChI=1S/C15H23NO2/c1-3-18-15(7-5-4-6-8-15)14(17)13-9-12(2)10-16-11-13/h9-11,14,17H,3-8H2,1-2H3
InChIKeyHQYLIZUGUDZHSV-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.16
Rot. Bonds4

About (1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol

(1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol (PubChem CID 116753621) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is (1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol.

Molecular Properties

Compound Name(1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol
PubChem CID116753621
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name(1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol
SMILESCCOC1(C(O)c2cncc(C)c2)CCCCC1
InChIInChI=1S/C15H23NO2/c1-3-18-15(7-5-4-6-8-15)14(17)13-9-12(2)10-16-11-13/h9-11,14,17H,3-8H2,1-2H3
InChIKeyHQYLIZUGUDZHSV-UHFFFAOYSA-N
XLogP3.16
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methanol
CID 116756160
(1-methoxycyclobutyl)-(5-methyl-3-pyridinyl)methanol
CID 116710441
(1-methoxycyclopentyl)-(5-methyl-3-pyridinyl)methanol
CID 104610441
N-[(1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methyl]ethanamine
CID 116764137
(1-ethoxycyclohexyl)-(3-fluoro-5-methylphenyl)methanol
CID 116753671
(1-ethoxycyclohexyl)-pyridin-3-ylmethanol
CID 116753647
(1-ethoxycyclopentyl)-(4-methylphenyl)methanol
CID 116753072
(3,5-difluorophenyl)-(1-ethoxycycloheptyl)methanol
CID 116756092
(1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol
CID 116753795
(1-ethoxycycloheptyl)-(3-fluoro-4-methylphenyl)methanol
CID 107128630
(1-ethoxycyclopentyl)-(4-methyl-3-pyridinyl)methanol
CID 116753217
(2,4-dimethylphenyl)-(1-ethoxycyclohexyl)methanol
CID 116753536

Frequently Asked Questions

What is the IUPAC name of (1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol?
The IUPAC name of (1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol (CID 116753621) is (1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol.
What is the SMILES notation for (1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol?
The canonical SMILES for (1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol is CCOC1(C(O)c2cncc(C)c2)CCCCC1.
What is the InChIKey of (1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol?
The InChIKey is HQYLIZUGUDZHSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-3-18-15(7-5-4-6-8-15)14(17)13-9-12(2)10-16-11-13/h9-11,14,17H,3-8H2,1-2H3.
What are the key properties of (1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol?
(1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol has a molecular weight of 249.35 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol is sourced from PubChem (CID 116753621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).