4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine

C14H18N2OS — CID 5091482

IUPAC4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine
SMILESCCOc1ccc(C(C)C)cc1-c1csc(N)n1
InChIInChI=1S/C14H18N2OS/c1-4-17-13-6-5-10(9(2)3)7-11(13)12-8-18-14(15)16-12/h5-9H,4H2,1-3H3,(H2,15,16)
InChIKeyVYQXSGXNGCWDPY-UHFFFAOYSA-N
MW262.38 g/mol
LogP3.91
Rot. Bonds4

About 4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine

4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine (PubChem CID 5091482) has the molecular formula C14H18N2OS and a molecular weight of 262.38 g/mol. Its IUPAC name is 4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine
PubChem CID5091482
Molecular FormulaC14H18N2OS
Molecular Weight262.38 g/mol
Exact Mass262.11
IUPAC Name4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine
SMILESCCOc1ccc(C(C)C)cc1-c1csc(N)n1
InChIInChI=1S/C14H18N2OS/c1-4-17-13-6-5-10(9(2)3)7-11(13)12-8-18-14(15)16-12/h5-9H,4H2,1-3H3,(H2,15,16)
InChIKeyVYQXSGXNGCWDPY-UHFFFAOYSA-N
XLogP3.91
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-ethoxy-5-fluorophenyl)-1,3-thiazol-2-amine
CID 5153390
4-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-2-amine
CID 82495942
1-[4-(2-ethoxy-5-methylphenyl)-1,3-thiazol-2-yl]-N-methylethanamine
CID 4308987
1-[4-(5-chloro-2-ethoxyphenyl)-1,3-thiazol-2-yl]-N-methylethanamine
CID 5239205
2-[4-(2-ethoxy-5-methylphenyl)-1,3-thiazol-2-yl]ethanamine
CID 3312423
4-[2,4,6-tri(propan-2-yl)phenyl]-1,3-thiazol-2-amine
CID 58442454
3-(2-amino-1,3-thiazol-4-yl)-8-ethoxychromen-2-one
CID 5207452
2-[4-(2-ethoxy-5-ethylphenyl)-1,3-thiazol-2-yl]ethanamine
CID 4223787
4-(4-ethoxy-1H-indol-3-yl)-1,3-thiazol-2-amine
CID 83163271
2-ethoxy-1-methoxy-4-propan-2-ylbenzene
CID 22087689
N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide
CID 17404838
ethyl 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]acetate;hydrobromide
CID 56832420

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine (CID 5091482) is 4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine is CCOc1ccc(C(C)C)cc1-c1csc(N)n1.
What is the InChIKey of 4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine?
The InChIKey is VYQXSGXNGCWDPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS/c1-4-17-13-6-5-10(9(2)3)7-11(13)12-8-18-14(15)16-12/h5-9H,4H2,1-3H3,(H2,15,16).
What are the key properties of 4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine?
4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine has a molecular weight of 262.38 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxy-5-propan-2-ylphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 5091482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).