2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine

C15H23N5S — CID 105157026

IUPAC2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine
SMILESCCc1nnsc1C(Cc1ccn(C2CCCC2)n1)NC
InChIInChI=1S/C15H23N5S/c1-3-13-15(21-19-17-13)14(16-2)10-11-8-9-20(18-11)12-6-4-5-7-12/h8-9,12,14,16H,3-7,10H2,1-2H3
InChIKeyAIOYSUVRAXFXPW-UHFFFAOYSA-N
MW305.45 g/mol
LogP2.92
Rot. Bonds6

About 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine

2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine (PubChem CID 105157026) has the molecular formula C15H23N5S and a molecular weight of 305.45 g/mol. Its IUPAC name is 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine
PubChem CID105157026
Molecular FormulaC15H23N5S
Molecular Weight305.45 g/mol
Exact Mass305.17
IUPAC Name2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine
SMILESCCc1nnsc1C(Cc1ccn(C2CCCC2)n1)NC
InChIInChI=1S/C15H23N5S/c1-3-13-15(21-19-17-13)14(16-2)10-11-8-9-20(18-11)12-6-4-5-7-12/h8-9,12,14,16H,3-7,10H2,1-2H3
InChIKeyAIOYSUVRAXFXPW-UHFFFAOYSA-N
XLogP2.92
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.45
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(1-cyclopentylpyrazol-3-yl)-N-methyl-1-phenylethanamine
CID 64777224
2-(1-cyclopentylpyrazol-3-yl)-1-(4-fluorophenyl)-N-methylethanamine
CID 64785855
2-(1-cyclopentylpyrazol-3-yl)-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 105157013
2-(1-cyclohexylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)ethanone
CID 105104785
2-(1-cyclopentylpyrazol-3-yl)-N-ethyl-1-(thiadiazol-4-yl)ethanamine
CID 105157069
2-(1-cyclopentylpyrazol-3-yl)-N-methyl-1-(6-methyl-3-pyridinyl)ethanamine
CID 105157078
2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-(1-methylimidazol-4-yl)ethanamine
CID 107975620
2-(1-cyclopentylpyrazol-3-yl)-N-methyl-1-(2-methylcyclopentyl)ethanamine
CID 107189365
2-(1-cyclopentylpyrazol-3-yl)-N-ethyl-1-pyrimidin-2-ylethanamine
CID 64778210
2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine
CID 64786076
[2-(1-cyclopentylpyrazol-3-yl)-1-(5-ethylfuran-2-yl)ethyl]hydrazine
CID 105314451
1-(1-cyclopentylpyrazol-3-yl)-N-ethylbutan-2-amine
CID 64779577

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine?
The IUPAC name of 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine (CID 105157026) is 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine.
What is the SMILES notation for 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine?
The canonical SMILES for 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine is CCc1nnsc1C(Cc1ccn(C2CCCC2)n1)NC.
What is the InChIKey of 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine?
The InChIKey is AIOYSUVRAXFXPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5S/c1-3-13-15(21-19-17-13)14(16-2)10-11-8-9-20(18-11)12-6-4-5-7-12/h8-9,12,14,16H,3-7,10H2,1-2H3.
What are the key properties of 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine?
2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine has a molecular weight of 305.45 g/mol, XLogP of 2.92, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylethanamine is sourced from PubChem (CID 105157026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).