1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol

C14H24N2O — CID 64770987

IUPAC1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol
SMILESCC(C)n1ccc(CC(O)C2CCCCC2)n1
InChIInChI=1S/C14H24N2O/c1-11(2)16-9-8-13(15-16)10-14(17)12-6-4-3-5-7-12/h8-9,11-12,14,17H,3-7,10H2,1-2H3
InChIKeyNBPZTTCTAAUUSL-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.95
Rot. Bonds4

About 1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol

1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol (PubChem CID 64770987) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol.

Molecular Properties

Compound Name1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol
PubChem CID64770987
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol
SMILESCC(C)n1ccc(CC(O)C2CCCCC2)n1
InChIInChI=1S/C14H24N2O/c1-11(2)16-9-8-13(15-16)10-14(17)12-6-4-3-5-7-12/h8-9,11-12,14,17H,3-7,10H2,1-2H3
InChIKeyNBPZTTCTAAUUSL-UHFFFAOYSA-N
XLogP2.95
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-propan-2-ylpyrazol-3-yl)-1-(thiolan-3-yl)ethanol
CID 105103437
N-[(1-propan-2-ylpyrazol-3-yl)methyl]cycloheptanamine
CID 64687559
1-cyclohexyl-1-ethoxy-3-(1-propan-2-ylpyrazol-3-yl)propan-2-amine
CID 116772099
3-methyl-4-(1-propan-2-ylpyrazol-3-yl)butan-2-ol
CID 64772656
2-[(1-propan-2-ylpyrazol-3-yl)methyl]cycloheptan-1-ol
CID 64772657
2-[(1-propan-2-ylpyrazol-3-yl)methyl]propane-1,3-diol
CID 79449988
N-methyl-1-(4-propan-2-ylcyclohexyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 65424963
1-[1-hydroxy-2-(1-propan-2-ylpyrazol-3-yl)ethyl]cycloheptan-1-ol
CID 103452043
2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylcyclohexyl)ethanol
CID 65393519
3-[1-fluoro-2-(1-propan-2-ylpyrazol-3-yl)ethyl]piperidine
CID 112565371
1-(4-cyclopropylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 79980806
N,2-dimethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine
CID 64773528

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol?
The IUPAC name of 1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol (CID 64770987) is 1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol.
What is the SMILES notation for 1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol?
The canonical SMILES for 1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol is CC(C)n1ccc(CC(O)C2CCCCC2)n1.
What is the InChIKey of 1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol?
The InChIKey is NBPZTTCTAAUUSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-11(2)16-9-8-13(15-16)10-14(17)12-6-4-3-5-7-12/h8-9,11-12,14,17H,3-7,10H2,1-2H3.
What are the key properties of 1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol?
1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol has a molecular weight of 236.36 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol is sourced from PubChem (CID 64770987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).