4-(3-methoxyphenyl)-1,3-thiazol-2-amine

C10H10N2OS — CID 734629

IUPAC4-(3-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1cccc(-c2csc(N)n2)c1
InChIInChI=1S/C10H10N2OS/c1-13-8-4-2-3-7(5-8)9-6-14-10(11)12-9/h2-6H,1H3,(H2,11,12)
InChIKeyNUMMWUVARLSQFR-UHFFFAOYSA-N
MW206.27 g/mol
LogP2.40
Rot. Bonds2

About 4-(3-methoxyphenyl)-1,3-thiazol-2-amine

4-(3-methoxyphenyl)-1,3-thiazol-2-amine (PubChem CID 734629) has the molecular formula C10H10N2OS and a molecular weight of 206.27 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(3-methoxyphenyl)-1,3-thiazol-2-amine
PubChem CID734629
Molecular FormulaC10H10N2OS
Molecular Weight206.27 g/mol
Exact Mass206.05
IUPAC Name4-(3-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1cccc(-c2csc(N)n2)c1
InChIInChI=1S/C10H10N2OS/c1-13-8-4-2-3-7(5-8)9-6-14-10(11)12-9/h2-6H,1H3,(H2,11,12)
InChIKeyNUMMWUVARLSQFR-UHFFFAOYSA-N
XLogP2.40
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(3-methoxyphenyl)-1,3-thiazol-2-amine (CID 734629) is 4-(3-methoxyphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(3-methoxyphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(3-methoxyphenyl)-1,3-thiazol-2-amine is COc1cccc(-c2csc(N)n2)c1.
What is the InChIKey of 4-(3-methoxyphenyl)-1,3-thiazol-2-amine?
The InChIKey is NUMMWUVARLSQFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2OS/c1-13-8-4-2-3-7(5-8)9-6-14-10(11)12-9/h2-6H,1H3,(H2,11,12).
What are the key properties of 4-(3-methoxyphenyl)-1,3-thiazol-2-amine?
4-(3-methoxyphenyl)-1,3-thiazol-2-amine has a molecular weight of 206.27 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxyphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 734629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).