N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine

C10H14N4S — CID 114558342

IUPACN-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine
SMILESCCNc1ncc(-c2ccnn2CC)s1
InChIInChI=1S/C10H14N4S/c1-3-11-10-12-7-9(15-10)8-5-6-13-14(8)4-2/h5-7H,3-4H2,1-2H3,(H,11,12)
InChIKeyHRPLEFLVMNDTFX-UHFFFAOYSA-N
MW222.32 g/mol
LogP2.46
Rot. Bonds4

About N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine

N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine (PubChem CID 114558342) has the molecular formula C10H14N4S and a molecular weight of 222.32 g/mol. Its IUPAC name is N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine
PubChem CID114558342
Molecular FormulaC10H14N4S
Molecular Weight222.32 g/mol
Exact Mass222.09
IUPAC NameN-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine
SMILESCCNc1ncc(-c2ccnn2CC)s1
InChIInChI=1S/C10H14N4S/c1-3-11-10-12-7-9(15-10)8-5-6-13-14(8)4-2/h5-7H,3-4H2,1-2H3,(H,11,12)
InChIKeyHRPLEFLVMNDTFX-UHFFFAOYSA-N
XLogP2.46
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.32
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine (CID 114558342) is N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine is CCNc1ncc(-c2ccnn2CC)s1.
What is the InChIKey of N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine?
The InChIKey is HRPLEFLVMNDTFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-3-11-10-12-7-9(15-10)8-5-6-13-14(8)4-2/h5-7H,3-4H2,1-2H3,(H,11,12).
What are the key properties of N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine?
N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine has a molecular weight of 222.32 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 114558342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).