5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine

C10H14N4S — CID 63296342

IUPAC5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCn1ccc(NC2=NCC(C3CC3)S2)n1
InChIInChI=1S/C10H14N4S/c1-14-5-4-9(13-14)12-10-11-6-8(15-10)7-2-3-7/h4-5,7-8H,2-3,6H2,1H3,(H,11,12,13)
InChIKeySQSAWFWKCASANL-UHFFFAOYSA-N
MW222.32 g/mol
LogP1.71
Rot. Bonds2

About 5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine

5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 63296342) has the molecular formula C10H14N4S and a molecular weight of 222.32 g/mol. Its IUPAC name is 5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID63296342
Molecular FormulaC10H14N4S
Molecular Weight222.32 g/mol
Exact Mass222.09
IUPAC Name5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCn1ccc(NC2=NCC(C3CC3)S2)n1
InChIInChI=1S/C10H14N4S/c1-14-5-4-9(13-14)12-10-11-6-8(15-10)7-2-3-7/h4-5,7-8H,2-3,6H2,1H3,(H,11,12,13)
InChIKeySQSAWFWKCASANL-UHFFFAOYSA-N
XLogP1.71
TPSA42.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.32
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine (CID 63296342) is 5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine is Cn1ccc(NC2=NCC(C3CC3)S2)n1.
What is the InChIKey of 5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is SQSAWFWKCASANL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-14-5-4-9(13-14)12-10-11-6-8(15-10)7-2-3-7/h4-5,7-8H,2-3,6H2,1H3,(H,11,12,13).
What are the key properties of 5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine?
5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 222.32 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(1-methylpyrazol-3-yl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 63296342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).