N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide

C19H19N3O2S — CID 3650326

IUPACN-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide
SMILESCCNc1nc(-c2ccc(NC(=O)c3ccccc3OC)cc2)cs1
InChIInChI=1S/C19H19N3O2S/c1-3-20-19-22-16(12-25-19)13-8-10-14(11-9-13)21-18(23)15-6-4-5-7-17(15)24-2/h4-12H,3H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyKQDHGZHGFNDQKD-UHFFFAOYSA-N
MW353.45 g/mol
LogP4.50
Rot. Bonds6

About N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide

N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide (PubChem CID 3650326) has the molecular formula C19H19N3O2S and a molecular weight of 353.45 g/mol. Its IUPAC name is N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide
PubChem CID3650326
Molecular FormulaC19H19N3O2S
Molecular Weight353.45 g/mol
Exact Mass353.12
IUPAC NameN-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide
SMILESCCNc1nc(-c2ccc(NC(=O)c3ccccc3OC)cc2)cs1
InChIInChI=1S/C19H19N3O2S/c1-3-20-19-22-16(12-25-19)13-8-10-14(11-9-13)21-18(23)15-6-4-5-7-17(15)24-2/h4-12H,3H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyKQDHGZHGFNDQKD-UHFFFAOYSA-N
XLogP4.50
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.45
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-methoxybenzamide
CID 868787
N-[4-[4-[(2R)-butan-2-yl]phenyl]-1,3-thiazol-2-yl]-2-methoxybenzamide
CID 6552731
2-methoxy-N-[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]benzamide
CID 4530772
2-phenoxy-N-[4-[2-[(2-phenoxybenzoyl)amino]-1,3-thiazol-4-yl]phenyl]benzamide
CID 4138513
2-methoxy-N-[2-methoxy-5-[2-(methylamino)-1,3-thiazol-4-yl]phenyl]benzamide
CID 100801615
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583
N-[[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]methyl]-2-methoxybenzamide
CID 110351798
2-(2-amino-2-oxoethoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 39448197
N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-2-methoxybenzamide
CID 27993083
N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyethoxy)benzamide
CID 60564262
2-methoxy-N-(4-quinolin-2-ylphenyl)benzamide
CID 46376165
methyl 2-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]carbamoyl]benzoate
CID 108727336

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide?
The IUPAC name of N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide (CID 3650326) is N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide.
What is the SMILES notation for N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide?
The canonical SMILES for N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide is CCNc1nc(-c2ccc(NC(=O)c3ccccc3OC)cc2)cs1.
What is the InChIKey of N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide?
The InChIKey is KQDHGZHGFNDQKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2S/c1-3-20-19-22-16(12-25-19)13-8-10-14(11-9-13)21-18(23)15-6-4-5-7-17(15)24-2/h4-12H,3H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide?
N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide has a molecular weight of 353.45 g/mol, XLogP of 4.50, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide is sourced from PubChem (CID 3650326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).