3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide

C18H20N2O2 — CID 110729116

IUPAC3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide
SMILESCOc1cccc(C(=O)Nc2ccc3c(c2)N(C)CCC3)c1
InChIInChI=1S/C18H20N2O2/c1-20-10-4-6-13-8-9-15(12-17(13)20)19-18(21)14-5-3-7-16(11-14)22-2/h3,5,7-9,11-12H,4,6,10H2,1-2H3,(H,19,21)
InChIKeyPIVNPRVJKRORTI-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.33
Rot. Bonds3

About 3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide

3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide (PubChem CID 110729116) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide.

Molecular Properties

Compound Name3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide
PubChem CID110729116
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide
SMILESCOc1cccc(C(=O)Nc2ccc3c(c2)N(C)CCC3)c1
InChIInChI=1S/C18H20N2O2/c1-20-10-4-6-13-8-9-15(12-17(13)20)19-18(21)14-5-3-7-16(11-14)22-2/h3,5,7-9,11-12H,4,6,10H2,1-2H3,(H,19,21)
InChIKeyPIVNPRVJKRORTI-UHFFFAOYSA-N
XLogP3.33
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-N-[1-(thiophene-2-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]benzamide
CID 7517400
1-(1-benzoyl-3,4-dihydro-2H-quinolin-7-yl)-3-(3-methoxyphenyl)urea
CID 30372497
N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 155946788
3-methoxy-N-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]benzamide
CID 110666844
3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide
CID 109057134
3,4,5-trimethoxy-N-(1-methyl-2,3-dihydroindol-6-yl)benzamide
CID 110729223
N-(3-methoxyphenyl)-1-methyl-3,4-dihydro-2H-quinolin-6-amine
CID 82537025
methyl 4-[(1-methyl-3,4-dihydro-2H-quinolin-7-yl)amino]-4-oxobutanoate
CID 110729112
N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-3-fluorobenzamide
CID 7527164
3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone
CID 755245
1-(3-methoxyphenyl)-3-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)ethyl]urea
CID 30379224
N-(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)-3,5-dimethoxybenzamide
CID 7656241

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide?
The IUPAC name of 3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide (CID 110729116) is 3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide.
What is the SMILES notation for 3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide?
The canonical SMILES for 3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide is COc1cccc(C(=O)Nc2ccc3c(c2)N(C)CCC3)c1.
What is the InChIKey of 3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide?
The InChIKey is PIVNPRVJKRORTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-20-10-4-6-13-8-9-15(12-17(13)20)19-18(21)14-5-3-7-16(11-14)22-2/h3,5,7-9,11-12H,4,6,10H2,1-2H3,(H,19,21).
What are the key properties of 3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide?
3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide has a molecular weight of 296.37 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)benzamide is sourced from PubChem (CID 110729116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).