N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide

C19H18N2O4 — CID 54359484

IUPACN-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide
SMILESCOc1cc2nccc(Oc3cccc(NC(C)=O)c3)c2cc1OC
InChIInChI=1S/C19H18N2O4/c1-12(22)21-13-5-4-6-14(9-13)25-17-7-8-20-16-11-19(24-3)18(23-2)10-15(16)17/h4-11H,1-3H3,(H,21,22)
InChIKeyULMIVTMJVKDEMN-UHFFFAOYSA-N
MW338.36 g/mol
LogP4.00
Rot. Bonds5

About N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide

N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide (PubChem CID 54359484) has the molecular formula C19H18N2O4 and a molecular weight of 338.36 g/mol. Its IUPAC name is N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide.

Molecular Properties

Compound NameN-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide
PubChem CID54359484
Molecular FormulaC19H18N2O4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC NameN-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide
SMILESCOc1cc2nccc(Oc3cccc(NC(C)=O)c3)c2cc1OC
InChIInChI=1S/C19H18N2O4/c1-12(22)21-13-5-4-6-14(9-13)25-17-7-8-20-16-11-19(24-3)18(23-2)10-15(16)17/h4-11H,1-3H3,(H,21,22)
InChIKeyULMIVTMJVKDEMN-UHFFFAOYSA-N
XLogP4.00
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 3-(6,7-dimethoxyquinolin-4-yl)oxybenzoate
CID 71377074
2-[4-(6,7-dimethoxyquinolin-4-yl)oxypyrazol-1-yl]-N-(3-methoxyphenyl)acetamide
CID 57396541
7-(6,7-dimethoxyquinolin-4-yl)oxy-N-[3-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide
CID 11376060
[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamic acid
CID 22936459
N-(3-bromopropyl)-3-(6,7-dimethoxyquinolin-4-yl)oxyaniline
CID 126738314
4-(3-acetamido-5-methoxyphenoxy)-7-methoxyquinoline-6-carboxamide
CID 166095714
1-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-3-methylurea
CID 23084603
N-[6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalen-2-yl]-2,3-difluorobenzamide
CID 59813365
1-(2,6-dichlorophenyl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]urea
CID 11225457
N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]pyridine-3-carboxamide
CID 22132777
1-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-3-[(2-methoxyphenyl)carbamoyl]urea
CID 22935499
4-(6,7-dimethoxyquinolin-4-yl)oxybenzoic acid
CID 22132796

Frequently Asked Questions

What is the IUPAC name of N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide?
The IUPAC name of N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide (CID 54359484) is N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide.
What is the SMILES notation for N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide?
The canonical SMILES for N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide is COc1cc2nccc(Oc3cccc(NC(C)=O)c3)c2cc1OC.
What is the InChIKey of N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide?
The InChIKey is ULMIVTMJVKDEMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4/c1-12(22)21-13-5-4-6-14(9-13)25-17-7-8-20-16-11-19(24-3)18(23-2)10-15(16)17/h4-11H,1-3H3,(H,21,22).
What are the key properties of N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide?
N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide has a molecular weight of 338.36 g/mol, XLogP of 4.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide is sourced from PubChem (CID 54359484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).