4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide

C12H16N4O2 — CID 62082159

IUPAC4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)NC(C)c2ccco2)c1N
InChIInChI=1S/C12H16N4O2/c1-3-8-10(13)11(16-15-8)12(17)14-7(2)9-5-4-6-18-9/h4-7H,3,13H2,1-2H3,(H,14,17)(H,15,16)
InChIKeyDFIRTYDIZUYBMQ-UHFFFAOYSA-N
MW248.29 g/mol
LogP1.64
Rot. Bonds4

About 4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide

4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide (PubChem CID 62082159) has the molecular formula C12H16N4O2 and a molecular weight of 248.29 g/mol. Its IUPAC name is 4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide
PubChem CID62082159
Molecular FormulaC12H16N4O2
Molecular Weight248.29 g/mol
Exact Mass248.13
IUPAC Name4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)NC(C)c2ccco2)c1N
InChIInChI=1S/C12H16N4O2/c1-3-8-10(13)11(16-15-8)12(17)14-7(2)9-5-4-6-18-9/h4-7H,3,13H2,1-2H3,(H,14,17)(H,15,16)
InChIKeyDFIRTYDIZUYBMQ-UHFFFAOYSA-N
XLogP1.64
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide
CID 62080944
4-amino-5-ethyl-N-(1-thiophen-3-ylethyl)-1H-pyrazole-3-carboxamide
CID 62841807
3-amino-N-[1-(furan-2-yl)ethyl]-1H-1,2,4-triazole-5-carboxamide
CID 62806480
4-amino-5-ethyl-N-(3-methylpentan-2-yl)-1H-pyrazole-3-carboxamide
CID 62080976
4-amino-5-ethyl-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-1H-pyrazole-3-carboxamide
CID 79248265
2-bromo-N-[1-(furan-2-yl)ethyl]butanamide
CID 62855564
4-amino-5-ethyl-N-hexan-3-yl-1H-pyrazole-3-carboxamide
CID 62092746
4-amino-5-ethyl-N-(4-propan-2-ylphenyl)-1H-pyrazole-3-carboxamide
CID 62082857
4-amino-5-ethyl-N-[[3-(hydroxymethyl)phenyl]methyl]-1H-pyrazole-3-carboxamide
CID 107210252
5-N-[(1R)-1-(furan-2-yl)ethyl]-2-N-hydroxythiophene-2,5-dicarboxamide
CID 10401418
4-amino-5-ethyl-N-(2-propan-2-yloxyethyl)-1H-pyrazole-3-carboxamide
CID 113449775
4-amino-3,5-dichloro-N-[1-(furan-2-yl)ethyl]benzamide
CID 82795088

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide (CID 62082159) is 4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide is CCc1[nH]nc(C(=O)NC(C)c2ccco2)c1N.
What is the InChIKey of 4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide?
The InChIKey is DFIRTYDIZUYBMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O2/c1-3-8-10(13)11(16-15-8)12(17)14-7(2)9-5-4-6-18-9/h4-7H,3,13H2,1-2H3,(H,14,17)(H,15,16).
What are the key properties of 4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide?
4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide has a molecular weight of 248.29 g/mol, XLogP of 1.64, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62082159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).