3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine

C12H14N4S — CID 121214960

IUPAC3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine
SMILESNCCCn1ccn2nc(-c3ccsc3)cc12
InChIInChI=1S/C12H14N4S/c13-3-1-4-15-5-6-16-12(15)8-11(14-16)10-2-7-17-9-10/h2,5-9H,1,3-4,13H2
InChIKeyRZWDXDJYUDSTOI-UHFFFAOYSA-N
MW246.34 g/mol
LogP2.21
Rot. Bonds4

About 3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine

3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine (PubChem CID 121214960) has the molecular formula C12H14N4S and a molecular weight of 246.34 g/mol. Its IUPAC name is 3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine.

Molecular Properties

Compound Name3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine
PubChem CID121214960
Molecular FormulaC12H14N4S
Molecular Weight246.34 g/mol
Exact Mass246.09
IUPAC Name3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine
SMILESNCCCn1ccn2nc(-c3ccsc3)cc12
InChIInChI=1S/C12H14N4S/c13-3-1-4-15-5-6-16-12(15)8-11(14-16)10-2-7-17-9-10/h2,5-9H,1,3-4,13H2
InChIKeyRZWDXDJYUDSTOI-UHFFFAOYSA-N
XLogP2.21
TPSA48.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.34
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(6-cyclobutylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine
CID 121214860
2-(2-aminoethyl)-6-thiophen-3-ylpyridazin-3-one
CID 122239427
2-(5-ethyl-3-thiophen-3-ylpyrazol-1-yl)ethanamine
CID 121211971
4-chloro-2-thiophen-3-ylpyrazolo[1,5-a]pyrazine
CID 91811759
(3-thiophen-3-ylpyrazol-1-yl)methanol
CID 121211936
2-[6-(furan-3-yl)imidazo[2,1-e]pyrazol-1-yl]acetonitrile
CID 121214980
1-(2-methylpropyl)-3-thiophen-3-ylpyrazol-5-amine
CID 121214181
5-(chloromethyl)-1-(difluoromethyl)-3-thiophen-3-ylpyrazole
CID 121211186
3-(3-phenylpyrazol-1-yl)propan-1-amine
CID 57225194
1-methyl-6-pyridin-4-ylimidazo[2,1-e]pyrazole
CID 121214917
3,4-dimethyl-5-[(3-thiophen-3-ylpyrazol-1-yl)methyl]-1,2,4-triazole
CID 84600000
1-[1-(2-fluoroethyl)-3-thiophen-3-ylpyrazol-5-yl]-N-methylmethanamine
CID 121211276

Frequently Asked Questions

What is the IUPAC name of 3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine?
The IUPAC name of 3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine (CID 121214960) is 3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine.
What is the SMILES notation for 3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine?
The canonical SMILES for 3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine is NCCCn1ccn2nc(-c3ccsc3)cc12.
What is the InChIKey of 3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine?
The InChIKey is RZWDXDJYUDSTOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4S/c13-3-1-4-15-5-6-16-12(15)8-11(14-16)10-2-7-17-9-10/h2,5-9H,1,3-4,13H2.
What are the key properties of 3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine?
3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine has a molecular weight of 246.34 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-thiophen-3-ylimidazo[2,1-e]pyrazol-1-yl)propan-1-amine is sourced from PubChem (CID 121214960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).