(1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone

C11H14N4O2 — CID 114641940

IUPAC(1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone
SMILESCCn1ncc(OC)c1C(=O)c1nccn1C
InChIInChI=1S/C11H14N4O2/c1-4-15-9(8(17-3)7-13-15)10(16)11-12-5-6-14(11)2/h5-7H,4H2,1-3H3
InChIKeyLZQZCGUXOOKEEI-UHFFFAOYSA-N
MW234.26 g/mol
LogP0.88
Rot. Bonds4

About (1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone

(1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone (PubChem CID 114641940) has the molecular formula C11H14N4O2 and a molecular weight of 234.26 g/mol. Its IUPAC name is (1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone.

Molecular Properties

Compound Name(1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone
PubChem CID114641940
Molecular FormulaC11H14N4O2
Molecular Weight234.26 g/mol
Exact Mass234.11
IUPAC Name(1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone
SMILESCCn1ncc(OC)c1C(=O)c1nccn1C
InChIInChI=1S/C11H14N4O2/c1-4-15-9(8(17-3)7-13-15)10(16)11-12-5-6-14(11)2/h5-7H,4H2,1-3H3
InChIKeyLZQZCGUXOOKEEI-UHFFFAOYSA-N
XLogP0.88
TPSA61.94 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

3-ethyl-1-(1-ethyl-4-methoxypyrazol-5-yl)pent-2-en-1-one
CID 103458666
(3,5-dichloro-2-pyridinyl)-(1-ethyl-4-methoxypyrazol-5-yl)methanone
CID 114641511
2-amino-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methylpropan-1-one
CID 114668718
[4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone
CID 105132998
2-(tert-butylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanone
CID 114670105
(1-ethyl-4-methoxypyrazol-5-yl)-(2-methylfuran-3-yl)methanone
CID 114642420
(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methanone
CID 106847992
(5-chloro-2-methoxyphenyl)-(1-ethyl-4-methoxypyrazol-5-yl)methanone
CID 115810197
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-pyridin-4-ylethanone
CID 114639766
(5-bromothiophen-3-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanone
CID 105133000
(4-methoxy-1-propylpyrazol-5-yl)-pyridin-2-ylmethanone
CID 114638964
(4-chloro-1-methylpyrazol-5-yl)-(1-methylimidazol-2-yl)methanone
CID 114641937

Frequently Asked Questions

What is the IUPAC name of (1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone?
The IUPAC name of (1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone (CID 114641940) is (1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone.
What is the SMILES notation for (1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone?
The canonical SMILES for (1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone is CCn1ncc(OC)c1C(=O)c1nccn1C.
What is the InChIKey of (1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone?
The InChIKey is LZQZCGUXOOKEEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2/c1-4-15-9(8(17-3)7-13-15)10(16)11-12-5-6-14(11)2/h5-7H,4H2,1-3H3.
What are the key properties of (1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone?
(1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone has a molecular weight of 234.26 g/mol, XLogP of 0.88, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone is sourced from PubChem (CID 114641940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).