4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine

C16H15N3OS — CID 29457657

IUPAC4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine
SMILESCCOc1ccc(-c2csc(Nc3ccccn3)n2)cc1
InChIInChI=1S/C16H15N3OS/c1-2-20-13-8-6-12(7-9-13)14-11-21-16(18-14)19-15-5-3-4-10-17-15/h3-11H,2H2,1H3,(H,17,18,19)
InChIKeyGJDFNMNXKWSVSC-UHFFFAOYSA-N
MW297.38 g/mol
LogP4.35
Rot. Bonds5

About 4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine

4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine (PubChem CID 29457657) has the molecular formula C16H15N3OS and a molecular weight of 297.38 g/mol. Its IUPAC name is 4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine
PubChem CID29457657
Molecular FormulaC16H15N3OS
Molecular Weight297.38 g/mol
Exact Mass297.09
IUPAC Name4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine
SMILESCCOc1ccc(-c2csc(Nc3ccccn3)n2)cc1
InChIInChI=1S/C16H15N3OS/c1-2-20-13-8-6-12(7-9-13)14-11-21-16(18-14)19-15-5-3-4-10-17-15/h3-11H,2H2,1H3,(H,17,18,19)
InChIKeyGJDFNMNXKWSVSC-UHFFFAOYSA-N
XLogP4.35
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-pyridin-2-yl-4-[4-(trifluoromethoxy)phenyl]-1,3-thiazol-2-amine
CID 122499786
4-[4-(2,2-dimethylpropylamino)phenyl]-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 122499792
4-(3,4-dimethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 556017
[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide
CID 171114823
4-(4-aminophenyl)-N-(4-ethoxyphenyl)-1,3-thiazol-2-amine
CID 13155729
4-(1H-pyrazol-4-yl)-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 42645487
N-(4-ethoxyphenyl)-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-amine
CID 23889663
N,4-bis(5-ethoxy-2-pyridinyl)-1,3-thiazol-2-amine
CID 163268876
4-(2,4-dimethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 25342683
N-(4-ethoxyphenyl)-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-amine
CID 2058270
N-[4-[2-(4-ethoxyanilino)-1,3-thiazol-4-yl]phenyl]propanamide
CID 3891823
N-[4-[4-[2-(pyridin-2-ylamino)-1,3-thiazol-4-yl]phenyl]butan-2-yl]acetamide
CID 42896369

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine (CID 29457657) is 4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine is CCOc1ccc(-c2csc(Nc3ccccn3)n2)cc1.
What is the InChIKey of 4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine?
The InChIKey is GJDFNMNXKWSVSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3OS/c1-2-20-13-8-6-12(7-9-13)14-11-21-16(18-14)19-15-5-3-4-10-17-15/h3-11H,2H2,1H3,(H,17,18,19).
What are the key properties of 4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine?
4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine has a molecular weight of 297.38 g/mol, XLogP of 4.35, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 29457657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).