2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol

C14H26N2O3 — CID 114645771

IUPAC2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol
SMILESCCCn1ncc(OC)c1C(O)C(CC)(CC)OC
InChIInChI=1S/C14H26N2O3/c1-6-9-16-12(11(18-4)10-15-16)13(17)14(7-2,8-3)19-5/h10,13,17H,6-9H2,1-5H3
InChIKeyGGXUULDNKMDDHT-UHFFFAOYSA-N
MW270.37 g/mol
LogP2.54
Rot. Bonds8

About 2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol

2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol (PubChem CID 114645771) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol
PubChem CID114645771
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol
SMILESCCCn1ncc(OC)c1C(O)C(CC)(CC)OC
InChIInChI=1S/C14H26N2O3/c1-6-9-16-12(11(18-4)10-15-16)13(17)14(7-2,8-3)19-5/h10,13,17H,6-9H2,1-5H3
InChIKeyGGXUULDNKMDDHT-UHFFFAOYSA-N
XLogP2.54
TPSA56.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-bromo-1-propylpyrazol-5-yl)-2-ethyl-2-methoxybutan-1-ol
CID 114645774
2-ethyl-2-methoxy-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)butan-1-ol
CID 114645769
1-(4-methoxy-1-propylpyrazol-5-yl)pentan-1-ol
CID 114635614
2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
CID 114644693
2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
CID 114643704
4-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)-3-methylbutan-1-ol
CID 105130553
(4-methoxy-1-propylpyrazol-5-yl)-(3-propylimidazol-4-yl)methanol
CID 114636682
(1,5-dimethylpyrazol-4-yl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114636784
3-bicyclo[3.1.0]hexanyl-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 115837684
1-(4-methoxy-1-propylpyrazol-5-yl)ethylhydrazine
CID 105201289
(4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanol
CID 105130490
furan-3-yl-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114635264

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol?
The IUPAC name of 2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol (CID 114645771) is 2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol.
What is the SMILES notation for 2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol?
The canonical SMILES for 2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol is CCCn1ncc(OC)c1C(O)C(CC)(CC)OC.
What is the InChIKey of 2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol?
The InChIKey is GGXUULDNKMDDHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-6-9-16-12(11(18-4)10-15-16)13(17)14(7-2,8-3)19-5/h10,13,17H,6-9H2,1-5H3.
What are the key properties of 2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol?
2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol has a molecular weight of 270.37 g/mol, XLogP of 2.54, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)butan-1-ol is sourced from PubChem (CID 114645771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).