1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol

C12H20N2O2 — CID 114633612

IUPAC1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol
SMILESCOc1cnn(C(C)C)c1C(C)(O)C1CC1
InChIInChI=1S/C12H20N2O2/c1-8(2)14-11(10(16-4)7-13-14)12(3,15)9-5-6-9/h7-9,15H,5-6H2,1-4H3
InChIKeyADUYYNFUVWIVPF-UHFFFAOYSA-N
MW224.30 g/mol
LogP2.09
Rot. Bonds4

About 1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol

1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol (PubChem CID 114633612) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol
PubChem CID114633612
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol
SMILESCOc1cnn(C(C)C)c1C(C)(O)C1CC1
InChIInChI=1S/C12H20N2O2/c1-8(2)14-11(10(16-4)7-13-14)12(3,15)9-5-6-9/h7-9,15H,5-6H2,1-4H3
InChIKeyADUYYNFUVWIVPF-UHFFFAOYSA-N
XLogP2.09
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-3,3-dimethylbutan-2-ol
CID 114637495
2-(4-methoxy-1-propan-2-ylpyrazol-5-yl)pentan-2-ol
CID 114637115
3-hydroxy-3-(4-methoxy-1-propan-2-ylpyrazol-5-yl)butanal
CID 114636600
4-[1-hydroxy-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethyl]phenol
CID 114637997
1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-1-(4-methylphenyl)ethanol
CID 114633338
1-(2-chlorophenyl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol
CID 114633450
2-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propan-1-ol
CID 115837387
2-(4-methoxy-1-methylpyrazol-5-yl)-3-methylbutan-2-ol
CID 114633592
1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol
CID 114637080
1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-1-(oxolan-3-yl)ethanol
CID 114638462
3-cyclopentyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propan-1-one
CID 115810604
4-methoxy-5-methyl-1-propan-2-ylpyrazole
CID 149332345

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol?
The IUPAC name of 1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol (CID 114633612) is 1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol.
What is the SMILES notation for 1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol?
The canonical SMILES for 1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol is COc1cnn(C(C)C)c1C(C)(O)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol?
The InChIKey is ADUYYNFUVWIVPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-8(2)14-11(10(16-4)7-13-14)12(3,15)9-5-6-9/h7-9,15H,5-6H2,1-4H3.
What are the key properties of 1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol?
1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol has a molecular weight of 224.30 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol is sourced from PubChem (CID 114633612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).