4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide

C14H20N4OS — CID 65358853

IUPAC4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide
SMILESCCCC(NC(=O)c1c(N)cnn1CC)c1cccs1
InChIInChI=1S/C14H20N4OS/c1-3-6-11(12-7-5-8-20-12)17-14(19)13-10(15)9-16-18(13)4-2/h5,7-9,11H,3-4,6,15H2,1-2H3,(H,17,19)
InChIKeyJHXNUCQSPJKEBE-UHFFFAOYSA-N
MW292.41 g/mol
LogP2.82
Rot. Bonds6

About 4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide

4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide (PubChem CID 65358853) has the molecular formula C14H20N4OS and a molecular weight of 292.41 g/mol. Its IUPAC name is 4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide
PubChem CID65358853
Molecular FormulaC14H20N4OS
Molecular Weight292.41 g/mol
Exact Mass292.14
IUPAC Name4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide
SMILESCCCC(NC(=O)c1c(N)cnn1CC)c1cccs1
InChIInChI=1S/C14H20N4OS/c1-3-6-11(12-7-5-8-20-12)17-14(19)13-10(15)9-16-18(13)4-2/h5,7-9,11H,3-4,6,15H2,1-2H3,(H,17,19)
InChIKeyJHXNUCQSPJKEBE-UHFFFAOYSA-N
XLogP2.82
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.41
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-amino-N-(1-thiophen-2-ylbutyl)pyridazine-3-carboxamide
CID 62161925
3-amino-2,6-difluoro-N-(1-thiophen-2-ylbutyl)benzamide
CID 79758784
3-oxo-3-(1-thiophen-2-ylbutylamino)propanoic acid
CID 62231148
4-amino-1-ethyl-N-(1-hydroxy-4,4-dimethylpentan-3-yl)pyrazole-5-carboxamide
CID 106347925
6-bromo-N-(1-thiophen-2-ylbutyl)pyridine-3-carboxamide
CID 66464915
4-amino-N-[1-(2-chlorophenyl)ethyl]-1-ethylpyrazole-5-carboxamide
CID 65357009
4-amino-1-ethyl-N-(1-hydroxy-3-methylbutan-2-yl)pyrazole-5-carboxamide
CID 79248487
4-amino-1-ethyl-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]pyrazole-5-carboxamide
CID 107860600
3-amino-3-sulfanylidene-N-(1-thiophen-2-ylbutyl)propanamide
CID 55134581
4-(methylamino)-N-(1-thiophen-2-ylbutyl)benzamide
CID 62173495
4-amino-1-ethyl-N-(4-methylpent-1-yn-3-yl)pyrazole-5-carboxamide
CID 114201947
2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide
CID 103515707

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide?
The IUPAC name of 4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide (CID 65358853) is 4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide is CCCC(NC(=O)c1c(N)cnn1CC)c1cccs1.
What is the InChIKey of 4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide?
The InChIKey is JHXNUCQSPJKEBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4OS/c1-3-6-11(12-7-5-8-20-12)17-14(19)13-10(15)9-16-18(13)4-2/h5,7-9,11H,3-4,6,15H2,1-2H3,(H,17,19).
What are the key properties of 4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide?
4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide has a molecular weight of 292.41 g/mol, XLogP of 2.82, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-N-(1-thiophen-2-ylbutyl)pyrazole-5-carboxamide is sourced from PubChem (CID 65358853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).