4-(2-methoxy-5-propylphenyl)-1,3-thiazole

C13H15NOS — CID 3562568

IUPAC4-(2-methoxy-5-propylphenyl)-1,3-thiazole
SMILESCCCc1ccc(OC)c(-c2cscn2)c1
InChIInChI=1S/C13H15NOS/c1-3-4-10-5-6-13(15-2)11(7-10)12-8-16-9-14-12/h5-9H,3-4H2,1-2H3
InChIKeyNZQLQRKRBAAEAP-UHFFFAOYSA-N
MW233.34 g/mol
LogP3.77
Rot. Bonds4

About 4-(2-methoxy-5-propylphenyl)-1,3-thiazole

4-(2-methoxy-5-propylphenyl)-1,3-thiazole (PubChem CID 3562568) has the molecular formula C13H15NOS and a molecular weight of 233.34 g/mol. Its IUPAC name is 4-(2-methoxy-5-propylphenyl)-1,3-thiazole.

Molecular Properties

Compound Name4-(2-methoxy-5-propylphenyl)-1,3-thiazole
PubChem CID3562568
Molecular FormulaC13H15NOS
Molecular Weight233.34 g/mol
Exact Mass233.09
IUPAC Name4-(2-methoxy-5-propylphenyl)-1,3-thiazole
SMILESCCCc1ccc(OC)c(-c2cscn2)c1
InChIInChI=1S/C13H15NOS/c1-3-4-10-5-6-13(15-2)11(7-10)12-8-16-9-14-12/h5-9H,3-4H2,1-2H3
InChIKeyNZQLQRKRBAAEAP-UHFFFAOYSA-N
XLogP3.77
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole
CID 4984858
4-(2,3,4-trimethoxyphenyl)-1,3-thiazole
CID 5239941
4-methoxy-3-(1,3-thiazol-4-yl)benzoic acid
CID 97033863
1-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
CID 4009901
1,2-dimethoxy-4-propylbenzene;methane
CID 159623020
4-(4-fluoro-2-methoxyphenyl)-1,3-thiazole
CID 177183935
1-methoxy-2-(4-methoxy-3-propylphenyl)-4-propylbenzene
CID 45267390
3-(2-methoxy-5-propylphenyl)-5-(piperazin-1-ylmethyl)-1,2-oxazole
CID 169196786
4-methoxy-3-(2-methoxy-5-propylphenyl)benzaldehyde
CID 15714587
N-benzyl-2-[2,5-dimethoxy-4-(1,3-thiazol-4-yl)phenyl]ethanamine
CID 169266782
4-(2-chloro-4-methoxyphenyl)-1,3-thiazole
CID 4998959
4-[4-[4-[4-(4-methoxyphenoxy)-2-propylphenoxy]butyl]phenyl]-1,3-thiazole
CID 141010243

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxy-5-propylphenyl)-1,3-thiazole?
The IUPAC name of 4-(2-methoxy-5-propylphenyl)-1,3-thiazole (CID 3562568) is 4-(2-methoxy-5-propylphenyl)-1,3-thiazole.
What is the SMILES notation for 4-(2-methoxy-5-propylphenyl)-1,3-thiazole?
The canonical SMILES for 4-(2-methoxy-5-propylphenyl)-1,3-thiazole is CCCc1ccc(OC)c(-c2cscn2)c1.
What is the InChIKey of 4-(2-methoxy-5-propylphenyl)-1,3-thiazole?
The InChIKey is NZQLQRKRBAAEAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NOS/c1-3-4-10-5-6-13(15-2)11(7-10)12-8-16-9-14-12/h5-9H,3-4H2,1-2H3.
What are the key properties of 4-(2-methoxy-5-propylphenyl)-1,3-thiazole?
4-(2-methoxy-5-propylphenyl)-1,3-thiazole has a molecular weight of 233.34 g/mol, XLogP of 3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxy-5-propylphenyl)-1,3-thiazole is sourced from PubChem (CID 3562568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).