2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol

C17H22N2O — CID 115813510

IUPAC2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol
SMILESCCc1cc(CC(O)C2CC2c2ccccc2)n(C)n1
InChIInChI=1S/C17H22N2O/c1-3-13-9-14(19(2)18-13)10-17(20)16-11-15(16)12-7-5-4-6-8-12/h4-9,15-17,20H,3,10-11H2,1-2H3
InChIKeyWVEKBPNPONJFBQ-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.69
Rot. Bonds5

About 2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol

2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol (PubChem CID 115813510) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol.

Molecular Properties

Compound Name2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol
PubChem CID115813510
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol
SMILESCCc1cc(CC(O)C2CC2c2ccccc2)n(C)n1
InChIInChI=1S/C17H22N2O/c1-3-13-9-14(19(2)18-13)10-17(20)16-11-15(16)12-7-5-4-6-8-12/h4-9,15-17,20H,3,10-11H2,1-2H3
InChIKeyWVEKBPNPONJFBQ-UHFFFAOYSA-N
XLogP2.69
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol
CID 115813118
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethanol
CID 115813447
2-(1-ethylimidazol-2-yl)-1-(2-phenylcyclopropyl)ethanol
CID 115819256
(1S)-1-[(1S,2S)-2-phenylcyclopropyl]ethane-1,2-diol
CID 11769104
(2S)-2-amino-3-(3-ethyl-1-methylpyrazol-5-yl)propanoic acid
CID 96758713
4-ethoxy-1-(3-ethyl-1-methylpyrazol-5-yl)butan-2-ol
CID 105107607
1-(4-aminophenyl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethanol
CID 106695553
(2-methylcyclopropyl)-(2-phenylcyclopropyl)methanol
CID 116517226
1-(2-bicyclo[2.2.1]heptanyl)-3-(3-ethyl-1-methylpyrazol-5-yl)propan-2-ol
CID 115813550
2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
CID 104999178
3-(1-methylpyrazol-4-yl)-1-(2-phenylcyclopropyl)propan-1-ol
CID 103027785
1-(2-phenylcyclopropyl)-2-(propan-2-ylamino)ethanol
CID 116518402

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol?
The IUPAC name of 2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol (CID 115813510) is 2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol.
What is the SMILES notation for 2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol?
The canonical SMILES for 2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol is CCc1cc(CC(O)C2CC2c2ccccc2)n(C)n1.
What is the InChIKey of 2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol?
The InChIKey is WVEKBPNPONJFBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-3-13-9-14(19(2)18-13)10-17(20)16-11-15(16)12-7-5-4-6-8-12/h4-9,15-17,20H,3,10-11H2,1-2H3.
What are the key properties of 2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol?
2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol has a molecular weight of 270.38 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-phenylcyclopropyl)ethanol is sourced from PubChem (CID 115813510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).