2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide

C19H16F2N2O3 — CID 86897632

IUPAC2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide
SMILESCOc1ccc2cc(NC(=O)Cc3cccc(OC(F)F)c3)ccc2n1
InChIInChI=1S/C19H16F2N2O3/c1-25-18-8-5-13-11-14(6-7-16(13)23-18)22-17(24)10-12-3-2-4-15(9-12)26-19(20)21/h2-9,11,19H,10H2,1H3,(H,22,24)
InChIKeyCAEYMQAIEQGSAZ-UHFFFAOYSA-N
MW358.34 g/mol
LogP4.03
Rot. Bonds6

About 2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide

2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide (PubChem CID 86897632) has the molecular formula C19H16F2N2O3 and a molecular weight of 358.34 g/mol. Its IUPAC name is 2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide.

Molecular Properties

Compound Name2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide
PubChem CID86897632
Molecular FormulaC19H16F2N2O3
Molecular Weight358.34 g/mol
Exact Mass358.11
IUPAC Name2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide
SMILESCOc1ccc2cc(NC(=O)Cc3cccc(OC(F)F)c3)ccc2n1
InChIInChI=1S/C19H16F2N2O3/c1-25-18-8-5-13-11-14(6-7-16(13)23-18)22-17(24)10-12-3-2-4-15(9-12)26-19(20)21/h2-9,11,19H,10H2,1H3,(H,22,24)
InChIKeyCAEYMQAIEQGSAZ-UHFFFAOYSA-N
XLogP4.03
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.34
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(difluoromethoxy)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 55742320
2-[4-(difluoromethoxy)phenyl]-N-(6-methoxy-3-pyridinyl)acetamide
CID 33142873
2-(3-methoxyphenyl)-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide
CID 2102300
N-(1H-indazol-6-yl)-2-(3-methoxyphenyl)acetamide
CID 36561093
N-(2-tert-butyl-3H-benzimidazol-5-yl)-2-(3-methoxyphenyl)acetamide
CID 39951309
2-(3-methoxyphenyl)-N-phenylacetamide
CID 2598681
N-[4-(difluoromethoxy)phenyl]-2-(3-methoxyphenoxy)acetamide
CID 2323436
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-[3-(difluoromethoxy)phenyl]acetamide
CID 86897326
N-(3-hydroxyphenyl)-2-(3-methoxyphenyl)acetamide
CID 28739724
2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide
CID 110879156
N-[4-(difluoromethoxy)phenyl]-2-(3-fluoro-4-methoxyphenyl)acetamide
CID 9046569
2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide
CID 90177419

Frequently Asked Questions

What is the IUPAC name of 2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide?
The IUPAC name of 2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide (CID 86897632) is 2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide.
What is the SMILES notation for 2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide?
The canonical SMILES for 2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide is COc1ccc2cc(NC(=O)Cc3cccc(OC(F)F)c3)ccc2n1.
What is the InChIKey of 2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide?
The InChIKey is CAEYMQAIEQGSAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N2O3/c1-25-18-8-5-13-11-14(6-7-16(13)23-18)22-17(24)10-12-3-2-4-15(9-12)26-19(20)21/h2-9,11,19H,10H2,1H3,(H,22,24).
What are the key properties of 2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide?
2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide has a molecular weight of 358.34 g/mol, XLogP of 4.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(difluoromethoxy)phenyl]-N-(2-methoxyquinolin-6-yl)acetamide is sourced from PubChem (CID 86897632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).