4-methoxy-N-(quinolin-4-ylmethyl)benzamide

C18H16N2O2 — CID 110734220

IUPAC4-methoxy-N-(quinolin-4-ylmethyl)benzamide
SMILESCOc1ccc(C(=O)NCc2ccnc3ccccc23)cc1
InChIInChI=1S/C18H16N2O2/c1-22-15-8-6-13(7-9-15)18(21)20-12-14-10-11-19-17-5-3-2-4-16(14)17/h2-11H,12H2,1H3,(H,20,21)
InChIKeyUFPMIYSTLHECAN-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.17
Rot. Bonds4

About 4-methoxy-N-(quinolin-4-ylmethyl)benzamide

4-methoxy-N-(quinolin-4-ylmethyl)benzamide (PubChem CID 110734220) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 4-methoxy-N-(quinolin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name4-methoxy-N-(quinolin-4-ylmethyl)benzamide
PubChem CID110734220
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name4-methoxy-N-(quinolin-4-ylmethyl)benzamide
SMILESCOc1ccc(C(=O)NCc2ccnc3ccccc23)cc1
InChIInChI=1S/C18H16N2O2/c1-22-15-8-6-13(7-9-15)18(21)20-12-14-10-11-19-17-5-3-2-4-16(14)17/h2-11H,12H2,1H3,(H,20,21)
InChIKeyUFPMIYSTLHECAN-UHFFFAOYSA-N
XLogP3.17
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 ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N-(quinolin-4-ylmethyl)aniline
CID 63850882
1-(4-methoxyphenyl)-N-(quinolin-4-ylmethyl)methanamine
CID 63850040
4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide
CID 71863321
N-[(4-methoxyphenyl)methyl]-4-(quinazolin-4-ylamino)benzamide
CID 2501443
2-(2-methoxyphenoxy)-N-(quinolin-4-ylmethyl)acetamide
CID 71979334
N-[(2-fluorophenyl)methyl]-4-methoxybenzamide
CID 7758239
4-methoxy-N-[[3-[[(4-methoxybenzoyl)amino]methyl]phenyl]methyl]benzamide
CID 4118576
N-(1,3-benzoxazol-2-ylmethyl)-4-methoxybenzamide
CID 110711644
N-[(2-fluorophenyl)methyl]-6-methoxyquinoline-4-carboxamide
CID 146075276
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
2-(3-methylphenyl)-N-(quinolin-4-ylmethyl)acetamide
CID 110734253
N-[(4-methoxyphenyl)methyl]-4-(4-phenoxypyrimidin-2-yl)benzamide
CID 46386504

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(quinolin-4-ylmethyl)benzamide?
The IUPAC name of 4-methoxy-N-(quinolin-4-ylmethyl)benzamide (CID 110734220) is 4-methoxy-N-(quinolin-4-ylmethyl)benzamide.
What is the SMILES notation for 4-methoxy-N-(quinolin-4-ylmethyl)benzamide?
The canonical SMILES for 4-methoxy-N-(quinolin-4-ylmethyl)benzamide is COc1ccc(C(=O)NCc2ccnc3ccccc23)cc1.
What is the InChIKey of 4-methoxy-N-(quinolin-4-ylmethyl)benzamide?
The InChIKey is UFPMIYSTLHECAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-22-15-8-6-13(7-9-15)18(21)20-12-14-10-11-19-17-5-3-2-4-16(14)17/h2-11H,12H2,1H3,(H,20,21).
What are the key properties of 4-methoxy-N-(quinolin-4-ylmethyl)benzamide?
4-methoxy-N-(quinolin-4-ylmethyl)benzamide has a molecular weight of 292.34 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(quinolin-4-ylmethyl)benzamide is sourced from PubChem (CID 110734220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).