2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide

C18H17N3O3S — CID 23067415

IUPAC2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCOc1ccccc1Oc1ccc(N)c(C(=O)Nc2nc(C)cs2)c1
InChIInChI=1S/C18H17N3O3S/c1-11-10-25-18(20-11)21-17(22)13-9-12(7-8-14(13)19)24-16-6-4-3-5-15(16)23-2/h3-10H,19H2,1-2H3,(H,20,21,22)
InChIKeySNFSLWVREUYDEZ-UHFFFAOYSA-N
MW355.42 g/mol
LogP4.09
Rot. Bonds5

About 2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide

2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 23067415) has the molecular formula C18H17N3O3S and a molecular weight of 355.42 g/mol. Its IUPAC name is 2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID23067415
Molecular FormulaC18H17N3O3S
Molecular Weight355.42 g/mol
Exact Mass355.10
IUPAC Name2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCOc1ccccc1Oc1ccc(N)c(C(=O)Nc2nc(C)cs2)c1
InChIInChI=1S/C18H17N3O3S/c1-11-10-25-18(20-11)21-17(22)13-9-12(7-8-14(13)19)24-16-6-4-3-5-15(16)23-2/h3-10H,19H2,1-2H3,(H,20,21,22)
InChIKeySNFSLWVREUYDEZ-UHFFFAOYSA-N
XLogP4.09
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.42
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide (CID 23067415) is 2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide is COc1ccccc1Oc1ccc(N)c(C(=O)Nc2nc(C)cs2)c1.
What is the InChIKey of 2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is SNFSLWVREUYDEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3S/c1-11-10-25-18(20-11)21-17(22)13-9-12(7-8-14(13)19)24-16-6-4-3-5-15(16)23-2/h3-10H,19H2,1-2H3,(H,20,21,22).
What are the key properties of 2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 355.42 g/mol, XLogP of 4.09, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 23067415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).