N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide

C20H19N3O3 — CID 60595070

IUPACN,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide
SMILESCN(C)C(=O)c1cccc(NC(=O)COc2ccc3ncccc3c2)c1
InChIInChI=1S/C20H19N3O3/c1-23(2)20(25)15-5-3-7-16(11-15)22-19(24)13-26-17-8-9-18-14(12-17)6-4-10-21-18/h3-12H,13H2,1-2H3,(H,22,24)
InChIKeyNPSOQZKDQSZANX-UHFFFAOYSA-N
MW349.39 g/mol
LogP2.95
Rot. Bonds5

About N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide

N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide (PubChem CID 60595070) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide
PubChem CID60595070
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC NameN,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide
SMILESCN(C)C(=O)c1cccc(NC(=O)COc2ccc3ncccc3c2)c1
InChIInChI=1S/C20H19N3O3/c1-23(2)20(25)15-5-3-7-16(11-15)22-19(24)13-26-17-8-9-18-14(12-17)6-4-10-21-18/h3-12H,13H2,1-2H3,(H,22,24)
InChIKeyNPSOQZKDQSZANX-UHFFFAOYSA-N
XLogP2.95
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-[(2-quinolin-6-yloxyacetyl)amino]benzoate
CID 112978710
3-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N,N-dimethylbenzamide
CID 29464616
N-(4-methoxyphenyl)-2-quinolin-6-yloxyacetamide
CID 112978693
3-[[2-(4-acetylphenoxy)acetyl]amino]-N,N-dimethylbenzamide
CID 32627222
3-[[2-(1,3-benzodioxol-5-yloxy)acetyl]amino]-N,N-dimethylbenzamide
CID 29454663
N-(3-chloro-4-methylphenyl)-2-quinolin-6-yloxyacetamide
CID 112978684
N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide
CID 112978729
N,N-dimethyl-3-[[2-[4-(trifluoromethyl)phenoxy]acetyl]amino]benzamide
CID 55523564
N-(1,3-benzodioxol-5-yl)-2-quinolin-6-yloxyacetamide
CID 112978730
N-ethyl-3-[(2-naphthalen-2-yloxyacetyl)amino]benzamide
CID 17230651
N-(2-methoxyethyl)-2-quinolin-6-yloxyacetamide
CID 47453984
3-[(2-naphthalen-2-yloxyacetyl)amino]benzoate
CID 6967346

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide?
The IUPAC name of N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide (CID 60595070) is N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide.
What is the SMILES notation for N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide?
The canonical SMILES for N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide is CN(C)C(=O)c1cccc(NC(=O)COc2ccc3ncccc3c2)c1.
What is the InChIKey of N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide?
The InChIKey is NPSOQZKDQSZANX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c1-23(2)20(25)15-5-3-7-16(11-15)22-19(24)13-26-17-8-9-18-14(12-17)6-4-10-21-18/h3-12H,13H2,1-2H3,(H,22,24).
What are the key properties of N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide?
N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide has a molecular weight of 349.39 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide is sourced from PubChem (CID 60595070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).