2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol

C12H22N2O3 — CID 114643704

IUPAC2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
SMILESCCCn1ncc(OC)c1C(O)C(C)OCC
InChIInChI=1S/C12H22N2O3/c1-5-7-14-11(10(16-4)8-13-14)12(15)9(3)17-6-2/h8-9,12,15H,5-7H2,1-4H3
InChIKeyZVZUYSLCVHTRQZ-UHFFFAOYSA-N
MW242.32 g/mol
LogP1.76
Rot. Bonds7

About 2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol

2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol (PubChem CID 114643704) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol.

Molecular Properties

Compound Name2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
PubChem CID114643704
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC Name2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
SMILESCCCn1ncc(OC)c1C(O)C(C)OCC
InChIInChI=1S/C12H22N2O3/c1-5-7-14-11(10(16-4)8-13-14)12(15)9(3)17-6-2/h8-9,12,15H,5-7H2,1-4H3
InChIKeyZVZUYSLCVHTRQZ-UHFFFAOYSA-N
XLogP1.76
TPSA56.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
CID 114644693
1-(4-methoxy-1-propylpyrazol-5-yl)pentan-1-ol
CID 114635614
2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol
CID 114645771
4-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)-3-methylbutan-1-ol
CID 105130553
1-(4-methoxy-1-propylpyrazol-5-yl)ethylhydrazine
CID 105201289
3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine
CID 114666702
(4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol
CID 105130490
2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine
CID 114661045
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methylbutan-1-ol
CID 114635185
3-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine
CID 114648518
2-ethoxy-1-(1-ethyl-4-methoxypyrazol-5-yl)-3,3-dimethylbutan-1-ol
CID 114645711
N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine
CID 114657709

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol?
The IUPAC name of 2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol (CID 114643704) is 2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol.
What is the SMILES notation for 2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol?
The canonical SMILES for 2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol is CCCn1ncc(OC)c1C(O)C(C)OCC.
What is the InChIKey of 2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol?
The InChIKey is ZVZUYSLCVHTRQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-5-7-14-11(10(16-4)8-13-14)12(15)9(3)17-6-2/h8-9,12,15H,5-7H2,1-4H3.
What are the key properties of 2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol?
2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol has a molecular weight of 242.32 g/mol, XLogP of 1.76, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol is sourced from PubChem (CID 114643704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).