4-(methoxymethyl)-N-quinolin-3-ylbenzamide

C18H16N2O2 — CID 18153378

IUPAC4-(methoxymethyl)-N-quinolin-3-ylbenzamide
SMILESCOCc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1
InChIInChI=1S/C18H16N2O2/c1-22-12-13-6-8-14(9-7-13)18(21)20-16-10-15-4-2-3-5-17(15)19-11-16/h2-11H,12H2,1H3,(H,20,21)
InChIKeyCHLNCWZZBUKCAU-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.63
Rot. Bonds4

About 4-(methoxymethyl)-N-quinolin-3-ylbenzamide

4-(methoxymethyl)-N-quinolin-3-ylbenzamide (PubChem CID 18153378) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 4-(methoxymethyl)-N-quinolin-3-ylbenzamide.

Molecular Properties

Compound Name4-(methoxymethyl)-N-quinolin-3-ylbenzamide
PubChem CID18153378
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name4-(methoxymethyl)-N-quinolin-3-ylbenzamide
SMILESCOCc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1
InChIInChI=1S/C18H16N2O2/c1-22-12-13-6-8-14(9-7-13)18(21)20-16-10-15-4-2-3-5-17(15)19-11-16/h2-11H,12H2,1H3,(H,20,21)
InChIKeyCHLNCWZZBUKCAU-UHFFFAOYSA-N
XLogP3.63
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-quinolin-3-ylbenzamide
CID 974969
4-(benzenesulfonylmethyl)-N-quinolin-3-ylbenzamide
CID 91641553
4-bromo-N-quinolin-3-ylbenzamide
CID 3301629
4-(2-methylbutan-2-yl)-N-quinolin-3-ylbenzamide
CID 66815675
N-(7-methoxyquinolin-3-yl)-4-phenylmethoxybenzamide
CID 95745112
2-(2-methoxyethoxy)-N-quinolin-3-ylpyridine-3-carboxamide
CID 60566317
methyl N-quinolin-3-ylcarbamate
CID 19697860
3-methoxy-4-prop-2-enoxy-N-quinolin-3-ylbenzamide
CID 29330284
6-(methylamino)-N-quinolin-3-ylpyridine-3-carboxamide
CID 62808644
1-(2-methoxyethyl)-3-quinolin-3-ylurea
CID 175700628
6-chloro-N-quinolin-3-ylpyridine-3-carboxamide
CID 29330391
4-(5-pentyl-2-pyridinyl)-N-quinolin-3-ylbenzamide
CID 5174853

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N-quinolin-3-ylbenzamide?
The IUPAC name of 4-(methoxymethyl)-N-quinolin-3-ylbenzamide (CID 18153378) is 4-(methoxymethyl)-N-quinolin-3-ylbenzamide.
What is the SMILES notation for 4-(methoxymethyl)-N-quinolin-3-ylbenzamide?
The canonical SMILES for 4-(methoxymethyl)-N-quinolin-3-ylbenzamide is COCc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1.
What is the InChIKey of 4-(methoxymethyl)-N-quinolin-3-ylbenzamide?
The InChIKey is CHLNCWZZBUKCAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-22-12-13-6-8-14(9-7-13)18(21)20-16-10-15-4-2-3-5-17(15)19-11-16/h2-11H,12H2,1H3,(H,20,21).
What are the key properties of 4-(methoxymethyl)-N-quinolin-3-ylbenzamide?
4-(methoxymethyl)-N-quinolin-3-ylbenzamide has a molecular weight of 292.34 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N-quinolin-3-ylbenzamide is sourced from PubChem (CID 18153378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).