1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole

C11H16N4O — CID 116804612

IUPAC1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole
SMILESCCn1cc(COc2cnn(CC)c2)cn1
InChIInChI=1S/C11H16N4O/c1-3-14-7-10(5-12-14)9-16-11-6-13-15(4-2)8-11/h5-8H,3-4,9H2,1-2H3
InChIKeyNSMOLZMTCKDCFA-UHFFFAOYSA-N
MW220.28 g/mol
LogP1.70
Rot. Bonds5

About 1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole

1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole (PubChem CID 116804612) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole.

Molecular Properties

Compound Name1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole
PubChem CID116804612
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole
SMILESCCn1cc(COc2cnn(CC)c2)cn1
InChIInChI=1S/C11H16N4O/c1-3-14-7-10(5-12-14)9-16-11-6-13-15(4-2)8-11/h5-8H,3-4,9H2,1-2H3
InChIKeyNSMOLZMTCKDCFA-UHFFFAOYSA-N
XLogP1.70
TPSA44.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(4-chlorophenoxy)methyl]-1-ethylpyrazole
CID 64764542
1-ethyl-4-[(3-ethylphenoxy)methyl]pyrazole
CID 64764003
3-[(1-ethylpyrazol-4-yl)methoxy]-5-methylphenol
CID 107679822
[5-[(1-ethylpyrazol-4-yl)methoxy]-2-pyridinyl]methanol
CID 79799636
[3-[(1-ethylpyrazol-4-yl)methoxy]phenyl]methanol
CID 62127102
4-[[3-(chloromethyl)phenoxy]methyl]-1-ethylpyrazole
CID 62127453
4-[(3-bromo-4-methoxyphenyl)methoxy]-1-ethylpyrazole
CID 116804533
5-[(1-ethylpyrazol-4-yl)methoxy]pyridine-3-carboxylic acid
CID 63852192
N-[[3-[(1-ethylpyrazol-4-yl)oxymethyl]phenyl]methyl]-2-methylpropan-2-amine
CID 116803349
N-[[4-[(1-ethylpyrazol-4-yl)methoxy]phenyl]methyl]-2-methylpropan-1-amine
CID 63063064
2-[4-[(1-ethylpyrazol-4-yl)oxymethyl]phenyl]-N-methylpropan-1-amine
CID 105351313
3-[(1-ethylpyrazol-4-yl)oxymethyl]benzoic acid
CID 116800034

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole?
The IUPAC name of 1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole (CID 116804612) is 1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole.
What is the SMILES notation for 1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole?
The canonical SMILES for 1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole is CCn1cc(COc2cnn(CC)c2)cn1.
What is the InChIKey of 1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole?
The InChIKey is NSMOLZMTCKDCFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-3-14-7-10(5-12-14)9-16-11-6-13-15(4-2)8-11/h5-8H,3-4,9H2,1-2H3.
What are the key properties of 1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole?
1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole has a molecular weight of 220.28 g/mol, XLogP of 1.70, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[(1-ethylpyrazol-4-yl)methoxy]pyrazole is sourced from PubChem (CID 116804612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).