2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide

C18H19N3O4S — CID 171536300

IUPAC2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide
SMILESCOCCOc1cc(-c2cncs2)nc2ccc(NC(=O)COC)cc12
InChIInChI=1S/C18H19N3O4S/c1-23-5-6-25-16-8-15(17-9-19-11-26-17)21-14-4-3-12(7-13(14)16)20-18(22)10-24-2/h3-4,7-9,11H,5-6,10H2,1-2H3,(H,20,22)
InChIKeyQLXXJQAWZQVKDG-UHFFFAOYSA-N
MW373.43 g/mol
LogP2.97
Rot. Bonds8

About 2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide

2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide (PubChem CID 171536300) has the molecular formula C18H19N3O4S and a molecular weight of 373.43 g/mol. Its IUPAC name is 2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide
PubChem CID171536300
Molecular FormulaC18H19N3O4S
Molecular Weight373.43 g/mol
Exact Mass373.11
IUPAC Name2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide
SMILESCOCCOc1cc(-c2cncs2)nc2ccc(NC(=O)COC)cc12
InChIInChI=1S/C18H19N3O4S/c1-23-5-6-25-16-8-15(17-9-19-11-26-17)21-14-4-3-12(7-13(14)16)20-18(22)10-24-2/h3-4,7-9,11H,5-6,10H2,1-2H3,(H,20,22)
InChIKeyQLXXJQAWZQVKDG-UHFFFAOYSA-N
XLogP2.97
TPSA82.57 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.43
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

methyl 2-[2-(4-chlorophenyl)-6-[(2-methoxyacetyl)amino]quinolin-4-yl]oxyacetate
CID 53113644
N-[2-(4-chlorophenyl)-4-methoxyquinolin-6-yl]-2-methoxyacetamide
CID 53001321
2-methoxy-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide
CID 31529238
N-(4-methoxy-2-methylquinolin-6-yl)-2-[2-[(4-methoxy-2-methylquinolin-6-yl)amino]-2-oxoethoxy]acetamide
CID 44533592
ethyl 2-[2-(4-fluorophenyl)-6-(propanoylamino)quinolin-4-yl]oxyacetate
CID 53113659
methyl 2-[6-[(4-chlorobenzoyl)amino]-2-(4-methylphenyl)quinolin-4-yl]oxyacetate
CID 53113515
N-[4-methoxy-2-(4-methylphenyl)quinolin-6-yl]benzamide
CID 53001311
N-[4-methoxy-2-(4-methoxyphenyl)quinolin-6-yl]benzamide
CID 53113445
N-[2-(4-fluorophenyl)-4-methoxyquinolin-6-yl]-3,4,5-trimethoxybenzamide
CID 45499103
methyl 2-[6-[(2-chlorobenzoyl)amino]-2-phenylquinolin-4-yl]oxyacetate
CID 53113511
methyl 2-[2-(4-fluorophenyl)-6-[(2-methoxybenzoyl)amino]quinolin-4-yl]oxyacetate
CID 53113586
methyl 2-[6-[(2-chlorobenzoyl)amino]-2-(4-methoxyphenyl)quinolin-4-yl]oxyacetate
CID 53113575

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide?
The IUPAC name of 2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide (CID 171536300) is 2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide.
What is the SMILES notation for 2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide?
The canonical SMILES for 2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide is COCCOc1cc(-c2cncs2)nc2ccc(NC(=O)COC)cc12.
What is the InChIKey of 2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide?
The InChIKey is QLXXJQAWZQVKDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4S/c1-23-5-6-25-16-8-15(17-9-19-11-26-17)21-14-4-3-12(7-13(14)16)20-18(22)10-24-2/h3-4,7-9,11H,5-6,10H2,1-2H3,(H,20,22).
What are the key properties of 2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide?
2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide has a molecular weight of 373.43 g/mol, XLogP of 2.97, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[4-(2-methoxyethoxy)-2-(1,3-thiazol-5-yl)quinolin-6-yl]acetamide is sourced from PubChem (CID 171536300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).