4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine

C10H17N3S — CID 110258507

IUPAC4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine
SMILESCC(C)N1CCCC1c1csc(N)n1
InChIInChI=1S/C10H17N3S/c1-7(2)13-5-3-4-9(13)8-6-14-10(11)12-8/h6-7,9H,3-5H2,1-2H3,(H2,11,12)
InChIKeyDIMGUSXXXKOSOF-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.27
Rot. Bonds2

About 4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine

4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine (PubChem CID 110258507) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine
PubChem CID110258507
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine
SMILESCC(C)N1CCCC1c1csc(N)n1
InChIInChI=1S/C10H17N3S/c1-7(2)13-5-3-4-9(13)8-6-14-10(11)12-8/h6-7,9H,3-5H2,1-2H3,(H2,11,12)
InChIKeyDIMGUSXXXKOSOF-UHFFFAOYSA-N
XLogP2.27
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine (CID 110258507) is 4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine is CC(C)N1CCCC1c1csc(N)n1.
What is the InChIKey of 4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine?
The InChIKey is DIMGUSXXXKOSOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-7(2)13-5-3-4-9(13)8-6-14-10(11)12-8/h6-7,9H,3-5H2,1-2H3,(H2,11,12).
What are the key properties of 4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine?
4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine has a molecular weight of 211.33 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-propan-2-ylpyrrolidin-2-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 110258507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).