2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride

C18H21ClN2O — CID 119685862

IUPAC2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride
SMILESCc1ccc2c(c1)CCCN2C(=O)CNc1ccccc1.Cl
InChIInChI=1S/C18H20N2O.ClH/c1-14-9-10-17-15(12-14)6-5-11-20(17)18(21)13-19-16-7-3-2-4-8-16;/h2-4,7-10,12,19H,5-6,11,13H2,1H3;1H
InChIKeyZACTZEIDWLCFOA-UHFFFAOYSA-N
MW316.83 g/mol
LogP3.81
Rot. Bonds3

About 2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride

2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride (PubChem CID 119685862) has the molecular formula C18H21ClN2O and a molecular weight of 316.83 g/mol. Its IUPAC name is 2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride.

Molecular Properties

Compound Name2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride
PubChem CID119685862
Molecular FormulaC18H21ClN2O
Molecular Weight316.83 g/mol
Exact Mass316.13
IUPAC Name2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride
SMILESCc1ccc2c(c1)CCCN2C(=O)CNc1ccccc1.Cl
InChIInChI=1S/C18H20N2O.ClH/c1-14-9-10-17-15(12-14)6-5-11-20(17)18(21)13-19-16-7-3-2-4-8-16;/h2-4,7-10,12,19H,5-6,11,13H2,1H3;1H
InChIKeyZACTZEIDWLCFOA-UHFFFAOYSA-N
XLogP3.81
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.83
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-phenylbutan-1-one
CID 112762073
2-tert-butylsulfanyl-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 112762105
3-methyl-5-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-5-oxopentanoic acid
CID 62964343
6-amino-4,4-dimethyl-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-1-one
CID 65293253
1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-one
CID 78776221
2-(4-acetylanilino)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 9080074
N-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]aniline
CID 60861432
2-amino-2-methyl-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-1-one
CID 61264398
4-hydroxy-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-one
CID 79204921
2-methyl-2-[(6-methyl-3,4-dihydro-2H-quinoline-1-carbonyl)amino]butanoic acid
CID 79791498
2-(2-chlorophenoxy)-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 24655671
10-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]acridin-9-one
CID 25332662

Frequently Asked Questions

What is the IUPAC name of 2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride?
The IUPAC name of 2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride (CID 119685862) is 2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride.
What is the SMILES notation for 2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride?
The canonical SMILES for 2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride is Cc1ccc2c(c1)CCCN2C(=O)CNc1ccccc1.Cl.
What is the InChIKey of 2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride?
The InChIKey is ZACTZEIDWLCFOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O.ClH/c1-14-9-10-17-15(12-14)6-5-11-20(17)18(21)13-19-16-7-3-2-4-8-16;/h2-4,7-10,12,19H,5-6,11,13H2,1H3;1H.
What are the key properties of 2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride?
2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride has a molecular weight of 316.83 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone;hydrochloride is sourced from PubChem (CID 119685862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).