4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine

C15H20N2OS — CID 63473179

IUPAC4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine
SMILESCCCNc1nc(-c2ccc(OCCC)cc2)cs1
InChIInChI=1S/C15H20N2OS/c1-3-9-16-15-17-14(11-19-15)12-5-7-13(8-6-12)18-10-4-2/h5-8,11H,3-4,9-10H2,1-2H3,(H,16,17)
InChIKeyBDWUVIVFXCGBKI-UHFFFAOYSA-N
MW276.41 g/mol
LogP4.42
Rot. Bonds7

About 4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine

4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine (PubChem CID 63473179) has the molecular formula C15H20N2OS and a molecular weight of 276.41 g/mol. Its IUPAC name is 4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine
PubChem CID63473179
Molecular FormulaC15H20N2OS
Molecular Weight276.41 g/mol
Exact Mass276.13
IUPAC Name4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine
SMILESCCCNc1nc(-c2ccc(OCCC)cc2)cs1
InChIInChI=1S/C15H20N2OS/c1-3-9-16-15-17-14(11-19-15)12-5-7-13(8-6-12)18-10-4-2/h5-8,11H,3-4,9-10H2,1-2H3,(H,16,17)
InChIKeyBDWUVIVFXCGBKI-UHFFFAOYSA-N
XLogP4.42
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.41
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine
CID 8962689
2-methyl-N-[[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]methyl]propan-2-amine
CID 62545171
N-[4-(4-butoxyphenyl)-1,3-thiazol-2-yl]-2-chloroacetamide
CID 19194823
2-phenyl-N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]acetamide
CID 3414920
4-(4-methoxyphenyl)-N-[(Z)-(4-propoxyphenyl)methylideneamino]-1,3-thiazol-2-amine
CID 110534560
2,5-dimethyl-N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]benzamide
CID 4591779
4-(4-chlorophenoxy)-N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]butanamide
CID 19184059
N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]-4-(4-propylphenoxy)butanamide
CID 19191455
[4-[4-(2-methoxyethoxy)phenyl]-1,3-thiazol-2-yl]hydrazine
CID 95471163
2-(3,4-dimethoxyphenyl)-N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]acetamide
CID 7920230
4-benzoyl-N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]benzamide
CID 5235425
[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide
CID 171114823

Frequently Asked Questions

What is the IUPAC name of 4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine?
The IUPAC name of 4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine (CID 63473179) is 4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine is CCCNc1nc(-c2ccc(OCCC)cc2)cs1.
What is the InChIKey of 4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine?
The InChIKey is BDWUVIVFXCGBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2OS/c1-3-9-16-15-17-14(11-19-15)12-5-7-13(8-6-12)18-10-4-2/h5-8,11H,3-4,9-10H2,1-2H3,(H,16,17).
What are the key properties of 4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine?
4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine has a molecular weight of 276.41 g/mol, XLogP of 4.42, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-propoxyphenyl)-N-propyl-1,3-thiazol-2-amine is sourced from PubChem (CID 63473179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).