(1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol

C14H24N2O2 — CID 116753795

IUPAC(1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol
SMILESCCOC1(C(O)c2cnn(CC)c2)CCCCC1
InChIInChI=1S/C14H24N2O2/c1-3-16-11-12(10-15-16)13(17)14(18-4-2)8-6-5-7-9-14/h10-11,13,17H,3-9H2,1-2H3
InChIKeyWGYVLOCUPRLTPB-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.68
Rot. Bonds5

About (1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol

(1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol (PubChem CID 116753795) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is (1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol.

Molecular Properties

Compound Name(1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol
PubChem CID116753795
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name(1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol
SMILESCCOC1(C(O)c2cnn(CC)c2)CCCCC1
InChIInChI=1S/C14H24N2O2/c1-3-16-11-12(10-15-16)13(17)14(18-4-2)8-6-5-7-9-14/h10-11,13,17H,3-9H2,1-2H3
InChIKeyWGYVLOCUPRLTPB-UHFFFAOYSA-N
XLogP2.68
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105278414
N-[(1-ethoxycyclopentyl)-(1-ethylpyrazol-4-yl)methyl]propan-1-amine
CID 116762353
(1-ethylpyrazol-4-yl)-(1-piperidin-1-ylcyclopentyl)methanol
CID 79059497
(1-ethoxycyclohexyl)-pyridin-3-ylmethanol
CID 116753647
(1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol
CID 116753621
(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methanol
CID 116756160
(3,5-difluorophenyl)-(1-ethoxycycloheptyl)methanol
CID 116756092
(1-ethoxycyclopentyl)-(4-methylphenyl)methanol
CID 116753072
(1-ethoxycycloheptyl)-(1-ethylimidazol-2-yl)methanol
CID 116756208
(1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol
CID 112742297
1-(1-ethoxycyclohexyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103008601
N-[(1-ethoxycyclopentyl)-(1-propylpyrazol-4-yl)methyl]ethanamine
CID 116762281

Frequently Asked Questions

What is the IUPAC name of (1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol?
The IUPAC name of (1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol (CID 116753795) is (1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol.
What is the SMILES notation for (1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol?
The canonical SMILES for (1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol is CCOC1(C(O)c2cnn(CC)c2)CCCCC1.
What is the InChIKey of (1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol?
The InChIKey is WGYVLOCUPRLTPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-3-16-11-12(10-15-16)13(17)14(18-4-2)8-6-5-7-9-14/h10-11,13,17H,3-9H2,1-2H3.
What are the key properties of (1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol?
(1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol has a molecular weight of 252.36 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol is sourced from PubChem (CID 116753795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).