4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine

C9H14N2S — CID 62075190

IUPAC4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine
SMILESCC(C)c1nc(C2CC2)c(N)s1
InChIInChI=1S/C9H14N2S/c1-5(2)9-11-7(6-3-4-6)8(10)12-9/h5-6H,3-4,10H2,1-2H3
InChIKeyFVYPTELELLYDOH-UHFFFAOYSA-N
MW182.29 g/mol
LogP2.73
Rot. Bonds2

About 4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine

4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine (PubChem CID 62075190) has the molecular formula C9H14N2S and a molecular weight of 182.29 g/mol. Its IUPAC name is 4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine.

Molecular Properties

Compound Name4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine
PubChem CID62075190
Molecular FormulaC9H14N2S
Molecular Weight182.29 g/mol
Exact Mass182.09
IUPAC Name4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine
SMILESCC(C)c1nc(C2CC2)c(N)s1
InChIInChI=1S/C9H14N2S/c1-5(2)9-11-7(6-3-4-6)8(10)12-9/h5-6H,3-4,10H2,1-2H3
InChIKeyFVYPTELELLYDOH-UHFFFAOYSA-N
XLogP2.73
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine?
The IUPAC name of 4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine (CID 62075190) is 4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine.
What is the SMILES notation for 4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine?
The canonical SMILES for 4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine is CC(C)c1nc(C2CC2)c(N)s1.
What is the InChIKey of 4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine?
The InChIKey is FVYPTELELLYDOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2S/c1-5(2)9-11-7(6-3-4-6)8(10)12-9/h5-6H,3-4,10H2,1-2H3.
What are the key properties of 4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine?
4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine has a molecular weight of 182.29 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-2-propan-2-yl-1,3-thiazol-5-amine is sourced from PubChem (CID 62075190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).