N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride

C19H22Cl2N2O — CID 45125627

IUPACN-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride
SMILESCCc1ccccc1Nc1cc(C)nc2c(OC)cccc12.Cl.Cl
InChIInChI=1S/C19H20N2O.2ClH/c1-4-14-8-5-6-10-16(14)21-17-12-13(2)20-19-15(17)9-7-11-18(19)22-3;;/h5-12H,4H2,1-3H3,(H,20,21);2*1H
InChIKeyXEMKUXNFXHUPMS-UHFFFAOYSA-N
MW365.30 g/mol
LogP5.70
Rot. Bonds4

About N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride

N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride (PubChem CID 45125627) has the molecular formula C19H22Cl2N2O and a molecular weight of 365.30 g/mol. Its IUPAC name is N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride.

Molecular Properties

Compound NameN-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride
PubChem CID45125627
Molecular FormulaC19H22Cl2N2O
Molecular Weight365.30 g/mol
Exact Mass364.11
IUPAC NameN-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride
SMILESCCc1ccccc1Nc1cc(C)nc2c(OC)cccc12.Cl.Cl
InChIInChI=1S/C19H20N2O.2ClH/c1-4-14-8-5-6-10-16(14)21-17-12-13(2)20-19-15(17)9-7-11-18(19)22-3;;/h5-12H,4H2,1-3H3,(H,20,21);2*1H
InChIKeyXEMKUXNFXHUPMS-UHFFFAOYSA-N
XLogP5.70
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.30
LogP ≤ 55.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine
CID 798265
2-[(8-methoxy-2-methylquinolin-4-yl)amino]phenol
CID 939061
ethyl 2-[(8-methoxy-2-methylquinolin-4-yl)amino]benzoate
CID 35208600
N-(3,4-dimethylphenyl)-8-methoxy-2-methylquinolin-4-amine;hydrochloride
CID 18590560
N-[(2-chlorophenyl)methyl]-8-methoxy-2-methylquinolin-4-amine
CID 19900495
8-methoxy-2-methyl-N-(3-methylphenyl)quinolin-4-amine
CID 110435559
4-[(8-methoxy-2-methylquinolin-4-yl)amino]benzenesulfonamide
CID 14052838
N-(3-chlorophenyl)-8-methoxy-2-methylquinolin-4-amine
CID 23880571
2-(chloromethyl)-8-methoxy-N-(2-methylphenyl)quinolin-4-amine;hydrochloride
CID 67899463
N-(3-chloro-4-methoxyphenyl)-8-methoxy-2-methylquinolin-4-amine
CID 798258
8-methoxy-N-(4-methoxy-2,2-dimethylbutyl)-2-methylquinolin-4-amine
CID 133459634
8-methoxy-2-methyl-N-[4-[[4-(N-pyridin-4-ylanilino)phenyl]methyl]phenyl]quinolin-4-amine
CID 137380219

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride?
The IUPAC name of N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride (CID 45125627) is N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride.
What is the SMILES notation for N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride?
The canonical SMILES for N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride is CCc1ccccc1Nc1cc(C)nc2c(OC)cccc12.Cl.Cl.
What is the InChIKey of N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride?
The InChIKey is XEMKUXNFXHUPMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O.2ClH/c1-4-14-8-5-6-10-16(14)21-17-12-13(2)20-19-15(17)9-7-11-18(19)22-3;;/h5-12H,4H2,1-3H3,(H,20,21);2*1H.
What are the key properties of N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride?
N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride has a molecular weight of 365.30 g/mol, XLogP of 5.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride is sourced from PubChem (CID 45125627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).