N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine

C14H16N4S — CID 103126767

IUPACN-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine
SMILESCCNC(Cc1ccsc1)c1cnn2ccncc12
InChIInChI=1S/C14H16N4S/c1-2-16-13(7-11-3-6-19-10-11)12-8-17-18-5-4-15-9-14(12)18/h3-6,8-10,13,16H,2,7H2,1H3
InChIKeyJDWHVUDSTLDNMD-UHFFFAOYSA-N
MW272.38 g/mol
LogP2.68
Rot. Bonds5

About N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine

N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine (PubChem CID 103126767) has the molecular formula C14H16N4S and a molecular weight of 272.38 g/mol. Its IUPAC name is N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine.

Molecular Properties

Compound NameN-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine
PubChem CID103126767
Molecular FormulaC14H16N4S
Molecular Weight272.38 g/mol
Exact Mass272.11
IUPAC NameN-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine
SMILESCCNC(Cc1ccsc1)c1cnn2ccncc12
InChIInChI=1S/C14H16N4S/c1-2-16-13(7-11-3-6-19-10-11)12-8-17-18-5-4-15-9-14(12)18/h3-6,8-10,13,16H,2,7H2,1H3
InChIKeyJDWHVUDSTLDNMD-UHFFFAOYSA-N
XLogP2.68
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.38
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126121
2-(5-bromothiophen-2-yl)-N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126678
N-ethyl-3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylbutan-1-amine
CID 103125922
2-(2-chlorophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126235
N-ethyl-4,4-dimethyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine
CID 103126890
N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-ylhexan-1-amine
CID 103126621
N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103127684
N-(1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-2-ylethyl)propan-1-amine
CID 103126662
N-ethyl-4-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpent-4-en-1-amine
CID 103128181
N-ethyl-3-(2-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylpropan-1-amine
CID 103128451
N,2-diethyl-1-pyrazolo[1,5-a]pyrazin-3-ylbutan-1-amine
CID 103127786
N-ethyl-1-isoquinolin-4-yl-2-thiophen-3-ylethanamine
CID 105147369

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine?
The IUPAC name of N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine (CID 103126767) is N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine.
What is the SMILES notation for N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine?
The canonical SMILES for N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine is CCNC(Cc1ccsc1)c1cnn2ccncc12.
What is the InChIKey of N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine?
The InChIKey is JDWHVUDSTLDNMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4S/c1-2-16-13(7-11-3-6-19-10-11)12-8-17-18-5-4-15-9-14(12)18/h3-6,8-10,13,16H,2,7H2,1H3.
What are the key properties of N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine?
N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine has a molecular weight of 272.38 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine is sourced from PubChem (CID 103126767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).