2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide

C9H15N3O2 — CID 116804462

IUPAC2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide
SMILESCCn1cc(OC(C)C(=O)NC)cn1
InChIInChI=1S/C9H15N3O2/c1-4-12-6-8(5-11-12)14-7(2)9(13)10-3/h5-7H,4H2,1-3H3,(H,10,13)
InChIKeyRFNRFXWFAKBFFG-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.42
Rot. Bonds4

About 2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide

2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide (PubChem CID 116804462) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide.

Molecular Properties

Compound Name2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide
PubChem CID116804462
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide
SMILESCCn1cc(OC(C)C(=O)NC)cn1
InChIInChI=1S/C9H15N3O2/c1-4-12-6-8(5-11-12)14-7(2)9(13)10-3/h5-7H,4H2,1-3H3,(H,10,13)
InChIKeyRFNRFXWFAKBFFG-UHFFFAOYSA-N
XLogP0.42
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-(1-ethylpyrazol-4-yl)oxypropanamide
CID 116804714
N-methyl-2-(1-methylpyrazol-4-yl)oxypropanamide
CID 116793988
N-butan-2-yl-2-(1-propylpyrazol-4-yl)oxypropanamide
CID 116804928
2-(1-ethylpyrazol-4-yl)oxy-N-methylbutan-1-amine
CID 116803166
ethyl 2-(1-ethylpyrazol-4-yl)oxy-2-fluoroacetate
CID 116800069
N-(ethylcarbamoyl)-2-(1-methylpyrazol-4-yl)oxypropanamide
CID 116794030
N-(3-methylbutyl)-2-(1-methylpyrazol-4-yl)oxypropanamide
CID 116793941
methyl 2-(1-ethylpyrazol-4-yl)oxyacetate
CID 116800028
methyl 4-(1-ethylpyrazol-4-yl)oxybutanoate
CID 116800049
N-pentan-2-yl-2-(1-propan-2-ylpyrazol-4-yl)oxypropanamide
CID 116805212
1-ethyl-N-propan-2-ylpyrazole-4-carboxamide
CID 19281043
N-methyl-2-phenoxypropanamide
CID 4626974

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide?
The IUPAC name of 2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide (CID 116804462) is 2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide.
What is the SMILES notation for 2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide?
The canonical SMILES for 2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide is CCn1cc(OC(C)C(=O)NC)cn1.
What is the InChIKey of 2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide?
The InChIKey is RFNRFXWFAKBFFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-4-12-6-8(5-11-12)14-7(2)9(13)10-3/h5-7H,4H2,1-3H3,(H,10,13).
What are the key properties of 2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide?
2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide has a molecular weight of 197.24 g/mol, XLogP of 0.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpyrazol-4-yl)oxy-N-methylpropanamide is sourced from PubChem (CID 116804462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).