(1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol

C13H22N2O2 — CID 112742297

IUPAC(1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol
SMILESCCOC1(C(O)c2c(C)cnn2C)CCCC1
InChIInChI=1S/C13H22N2O2/c1-4-17-13(7-5-6-8-13)12(16)11-10(2)9-14-15(11)3/h9,12,16H,4-8H2,1-3H3
InChIKeyWHHNOAOJRXXUCS-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.11
Rot. Bonds4

About (1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol

(1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol (PubChem CID 112742297) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is (1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol.

Molecular Properties

Compound Name(1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol
PubChem CID112742297
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name(1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol
SMILESCCOC1(C(O)c2c(C)cnn2C)CCCC1
InChIInChI=1S/C13H22N2O2/c1-4-17-13(7-5-6-8-13)12(16)11-10(2)9-14-15(11)3/h9,12,16H,4-8H2,1-3H3
InChIKeyWHHNOAOJRXXUCS-UHFFFAOYSA-N
XLogP2.11
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-bromo-1-methylpyrazol-5-yl)-(1-ethoxy-4,4-dimethylcyclohexyl)methanol
CID 114645902
(4-bromo-1-propan-2-ylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol
CID 114645787
(1-ethoxycyclohexyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114645814
(1-ethoxycyclopentyl)-(4-methyl-3-pyridinyl)methanol
CID 116753217
(1-ethoxycyclopentyl)-(4-methylphenyl)methanol
CID 116753072
(1-ethoxycyclohexyl)-(1-ethylpyrazol-4-yl)methanol
CID 116753795
(1-methoxycyclopentyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 114645508
1-(1,4-dimethylpyrazol-5-yl)-2-(1-methylcyclopropyl)ethanol
CID 130943640
(1-ethoxycyclohexyl)-(5-methyl-3-pyridinyl)methanol
CID 116753621
(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methanol
CID 116756160
(2,4-dimethylphenyl)-(1-ethoxycyclohexyl)methanol
CID 116753536
1-(1-ethoxycyclohexyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103008601

Frequently Asked Questions

What is the IUPAC name of (1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol?
The IUPAC name of (1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol (CID 112742297) is (1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol.
What is the SMILES notation for (1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol?
The canonical SMILES for (1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol is CCOC1(C(O)c2c(C)cnn2C)CCCC1.
What is the InChIKey of (1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol?
The InChIKey is WHHNOAOJRXXUCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-4-17-13(7-5-6-8-13)12(16)11-10(2)9-14-15(11)3/h9,12,16H,4-8H2,1-3H3.
What are the key properties of (1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol?
(1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol has a molecular weight of 238.33 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1,4-dimethylpyrazol-5-yl)-(1-ethoxycyclopentyl)methanol is sourced from PubChem (CID 112742297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).