4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine

C10H16N2OS — CID 64919659

IUPAC4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine
SMILESCOCCNc1nc(C2CC2)c(C)s1
InChIInChI=1S/C10H16N2OS/c1-7-9(8-3-4-8)12-10(14-7)11-5-6-13-2/h8H,3-6H2,1-2H3,(H,11,12)
InChIKeyBPQMAPRMBMUSJJ-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.39
Rot. Bonds5

About 4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine

4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine (PubChem CID 64919659) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine
PubChem CID64919659
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine
SMILESCOCCNc1nc(C2CC2)c(C)s1
InChIInChI=1S/C10H16N2OS/c1-7-9(8-3-4-8)12-10(14-7)11-5-6-13-2/h8H,3-6H2,1-2H3,(H,11,12)
InChIKeyBPQMAPRMBMUSJJ-UHFFFAOYSA-N
XLogP2.39
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine?
The IUPAC name of 4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine (CID 64919659) is 4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine is COCCNc1nc(C2CC2)c(C)s1.
What is the InChIKey of 4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine?
The InChIKey is BPQMAPRMBMUSJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-7-9(8-3-4-8)12-10(14-7)11-5-6-13-2/h8H,3-6H2,1-2H3,(H,11,12).
What are the key properties of 4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine?
4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine has a molecular weight of 212.32 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 64919659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).