N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide

C17H18N2O2 — CID 808207

IUPACN-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide
SMILESCOc1ccccc1NC(=O)N1CCCc2ccccc21
InChIInChI=1S/C17H18N2O2/c1-21-16-11-5-3-9-14(16)18-17(20)19-12-6-8-13-7-2-4-10-15(13)19/h2-5,7,9-11H,6,8,12H2,1H3,(H,18,20)
InChIKeyVGJHYDGTJKYGLB-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.68
Rot. Bonds2

About N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide

N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide (PubChem CID 808207) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide
PubChem CID808207
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide
SMILESCOc1ccccc1NC(=O)N1CCCc2ccccc21
InChIInChI=1S/C17H18N2O2/c1-21-16-11-5-3-9-14(16)18-17(20)19-12-6-8-13-7-2-4-10-15(13)19/h2-5,7,9-11H,6,8,12H2,1H3,(H,18,20)
InChIKeyVGJHYDGTJKYGLB-UHFFFAOYSA-N
XLogP3.68
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Piperazine, 1-(2-methoxyphenyl)-4-(2-phenylethyl)-
CID 3826471
1-(2-(dimethylamino)-4-(trifluoromethyl)benzyl)-3-(3,4-dihydro-3-oxo-2H-benzo[b][1,4]oxazin-8-yl)urea
CID 53476470
1-(2-Methoxyphenyl)-3-naphthalen-1-ylurea
CID 768067
N-[(4-methoxyphenyl)methyl]-4-phenylpiperazine-1-carboxamide
CID 9155553
2-Methoxyfentanyl
CID 12741853
2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-methylphenyl)acetamide
CID 2653640
1-[4-[4-(2-Methoxyphenyl)piperazin-1-yl]butyl]-3,4-dihydroquinolin-2-one
CID 10340555
1-{(1R,2S)-2-[(S)-3-(4-Fluoro-benzyl)-piperidin-1-ylmethyl]-cyclohexyl}-3-(4-methoxy-phenyl)-urea
CID 11363006
1-(2-Methoxyphenyl)-4-(4-phenylbutyl)piperazine
CID 44276571
N-(2-ethoxyphenyl)-3,4-dihydroquinoline-1(2H)-carbothioamide
CID 714721
1-(2-Methoxyphenyl)-5-(2-phenylethyl)-1,3,5-triazinane-2-thione
CID 751683
N-(2-methoxyphenyl)-N'-(2-phenylethyl)urea
CID 853786

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide (CID 808207) is N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide is COc1ccccc1NC(=O)N1CCCc2ccccc21.
What is the InChIKey of N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide?
The InChIKey is VGJHYDGTJKYGLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-21-16-11-5-3-9-14(16)18-17(20)19-12-6-8-13-7-2-4-10-15(13)19/h2-5,7,9-11H,6,8,12H2,1H3,(H,18,20).
What are the key properties of N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide?
N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide has a molecular weight of 282.34 g/mol, XLogP of 3.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide is sourced from PubChem (CID 808207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).