3-ethyl-1-methylpyrazole-5-carboxamide

C7H11N3O — CID 66119758

IUPAC3-ethyl-1-methylpyrazole-5-carboxamide
SMILESCCc1cc(C(N)=O)n(C)n1
InChIInChI=1S/C7H11N3O/c1-3-5-4-6(7(8)11)10(2)9-5/h4H,3H2,1-2H3,(H2,8,11)
InChIKeyMPMGWUUFODLBFH-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.08
Rot. Bonds2

About 3-ethyl-1-methylpyrazole-5-carboxamide

3-ethyl-1-methylpyrazole-5-carboxamide (PubChem CID 66119758) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 3-ethyl-1-methylpyrazole-5-carboxamide.

Molecular Properties

Compound Name3-ethyl-1-methylpyrazole-5-carboxamide
PubChem CID66119758
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name3-ethyl-1-methylpyrazole-5-carboxamide
SMILESCCc1cc(C(N)=O)n(C)n1
InChIInChI=1S/C7H11N3O/c1-3-5-4-6(7(8)11)10(2)9-5/h4H,3H2,1-2H3,(H2,8,11)
InChIKeyMPMGWUUFODLBFH-UHFFFAOYSA-N
XLogP0.08
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-1-methylpyrazole-5-carboxylic acid
CID 820565
[(3-ethyl-1-methylpyrazole-5-carbonyl)amino]urea
CID 66120179
1-methyl-3-(2,2,2-trifluoroethyl)pyrazole-5-carboxamide
CID 177051073
N-(2-aminoethyl)-3-ethyl-1-methylpyrazole-5-carboxamide
CID 66120701
1-(3-ethyl-1-methylpyrazol-5-yl)-2-methylbutan-1-one
CID 105119427
1-(3-ethyl-1-methylpyrazol-5-yl)-2-methoxyethanone
CID 105115019
N-(2-chloropropyl)-3-ethyl-1-methylpyrazole-5-carboxamide
CID 114296603
N-cyano-3-ethyl-1-methylpyrazole-5-carboxamide
CID 79193800
tert-butyl 3-ethyl-1-methylpyrazole-5-carboxylate
CID 66120943
(3-ethyl-1-methylpyrazol-5-yl)-pyrrolidin-1-ylmethanone
CID 66120347
2-[(3-ethyl-1-methylpyrazole-5-carbonyl)amino]oxyacetic acid
CID 66121113
N-(1-amino-1-hydroxyiminopropan-2-yl)-3-ethyl-1-methylpyrazole-5-carboxamide
CID 77113214

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-methylpyrazole-5-carboxamide?
The IUPAC name of 3-ethyl-1-methylpyrazole-5-carboxamide (CID 66119758) is 3-ethyl-1-methylpyrazole-5-carboxamide.
What is the SMILES notation for 3-ethyl-1-methylpyrazole-5-carboxamide?
The canonical SMILES for 3-ethyl-1-methylpyrazole-5-carboxamide is CCc1cc(C(N)=O)n(C)n1.
What is the InChIKey of 3-ethyl-1-methylpyrazole-5-carboxamide?
The InChIKey is MPMGWUUFODLBFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-3-5-4-6(7(8)11)10(2)9-5/h4H,3H2,1-2H3,(H2,8,11).
What are the key properties of 3-ethyl-1-methylpyrazole-5-carboxamide?
3-ethyl-1-methylpyrazole-5-carboxamide has a molecular weight of 153.18 g/mol, XLogP of 0.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-methylpyrazole-5-carboxamide is sourced from PubChem (CID 66119758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).