(2-ethylcyclohexyl)-pyridin-3-ylmethanol

C14H21NO — CID 63863632

IUPAC(2-ethylcyclohexyl)-pyridin-3-ylmethanol
SMILESCCC1CCCCC1C(O)c1cccnc1
InChIInChI=1S/C14H21NO/c1-2-11-6-3-4-8-13(11)14(16)12-7-5-9-15-10-12/h5,7,9-11,13-14,16H,2-4,6,8H2,1H3
InChIKeyZPKPIFDXAOPPQI-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.33
Rot. Bonds3

About (2-ethylcyclohexyl)-pyridin-3-ylmethanol

(2-ethylcyclohexyl)-pyridin-3-ylmethanol (PubChem CID 63863632) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is (2-ethylcyclohexyl)-pyridin-3-ylmethanol.

Molecular Properties

Compound Name(2-ethylcyclohexyl)-pyridin-3-ylmethanol
PubChem CID63863632
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name(2-ethylcyclohexyl)-pyridin-3-ylmethanol
SMILESCCC1CCCCC1C(O)c1cccnc1
InChIInChI=1S/C14H21NO/c1-2-11-6-3-4-8-13(11)14(16)12-7-5-9-15-10-12/h5,7,9-11,13-14,16H,2-4,6,8H2,1H3
InChIKeyZPKPIFDXAOPPQI-UHFFFAOYSA-N
XLogP3.33
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-ethylcyclohexyl)-pyrimidin-5-ylmethanol
CID 102924025
2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine
CID 81407298
2-ethyl-N-[(1R)-1-pyridin-3-ylethyl]cyclopentan-1-amine
CID 104865522
(3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol
CID 63895871
(2-ethylcyclohexyl)-(4-methylsulfanylphenyl)methanol
CID 115801687
2-cyclohexyl-1-pyridin-3-ylethanol
CID 22768104
N-ethyl-1-(2-ethylcyclohexyl)-2-pyridin-3-ylethanamine
CID 63861666
pyridin-3-yl(pyrrolidin-2-yl)methanol
CID 22605701
(2-ethylcyclohexyl)-(furan-2-yl)methanol
CID 63861285
(2-aminophenyl)-(2-ethylcyclohexyl)methanol
CID 64831996
(2-ethylcyclohexyl)-(thiadiazol-5-yl)methanol
CID 105100259
(2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol
CID 63893975

Frequently Asked Questions

What is the IUPAC name of (2-ethylcyclohexyl)-pyridin-3-ylmethanol?
The IUPAC name of (2-ethylcyclohexyl)-pyridin-3-ylmethanol (CID 63863632) is (2-ethylcyclohexyl)-pyridin-3-ylmethanol.
What is the SMILES notation for (2-ethylcyclohexyl)-pyridin-3-ylmethanol?
The canonical SMILES for (2-ethylcyclohexyl)-pyridin-3-ylmethanol is CCC1CCCCC1C(O)c1cccnc1.
What is the InChIKey of (2-ethylcyclohexyl)-pyridin-3-ylmethanol?
The InChIKey is ZPKPIFDXAOPPQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-2-11-6-3-4-8-13(11)14(16)12-7-5-9-15-10-12/h5,7,9-11,13-14,16H,2-4,6,8H2,1H3.
What are the key properties of (2-ethylcyclohexyl)-pyridin-3-ylmethanol?
(2-ethylcyclohexyl)-pyridin-3-ylmethanol has a molecular weight of 219.33 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylcyclohexyl)-pyridin-3-ylmethanol is sourced from PubChem (CID 63863632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).