N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride

C19H18Cl2N4O — CID 135818936

IUPACN-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride
SMILESCCOc1ccc(Nc2cc(C)[nH]c3ccc4ncnc4c23)cc1Cl.Cl
InChIInChI=1S/C19H17ClN4O.ClH/c1-3-25-17-7-4-12(9-13(17)20)24-16-8-11(2)23-14-5-6-15-19(18(14)16)22-10-21-15;/h4-10,23-24H,3H2,1-2H3;1H
InChIKeyWWZRUPKRZFDNRY-UHFFFAOYSA-N
MW389.29 g/mol
LogP5.64
Rot. Bonds4

About N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride

N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride (PubChem CID 135818936) has the molecular formula C19H18Cl2N4O and a molecular weight of 389.29 g/mol. Its IUPAC name is N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride.

Molecular Properties

Compound NameN-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride
PubChem CID135818936
Molecular FormulaC19H18Cl2N4O
Molecular Weight389.29 g/mol
Exact Mass388.09
IUPAC NameN-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride
SMILESCCOc1ccc(Nc2cc(C)[nH]c3ccc4ncnc4c23)cc1Cl.Cl
InChIInChI=1S/C19H17ClN4O.ClH/c1-3-25-17-7-4-12(9-13(17)20)24-16-8-11(2)23-14-5-6-15-19(18(14)16)22-10-21-15;/h4-10,23-24H,3H2,1-2H3;1H
InChIKeyWWZRUPKRZFDNRY-UHFFFAOYSA-N
XLogP5.64
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.29
LogP ≤ 55.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dichlorophenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride
CID 135819017
N-(3-chloro-4-fluorophenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine
CID 135819020
bis(7-methyl-N-(4-propan-2-ylphenyl)-6H-imidazo[4,5-f]quinolin-9-amine);hydrate;dihydrochloride
CID 137220071
N-(1,3-benzodioxol-5-yl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine
CID 135818945
N-[(4-methoxyphenyl)methyl]-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine
CID 135818954
6-chloro-N-[3-chloro-4-(oxetan-3-ylmethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine
CID 166540295
3-chloro-4-ethoxy-N-[(5-methyl-1H-pyrazol-4-yl)methyl]aniline
CID 54864056
3-chloro-4-ethoxy-N-[(2-methyl-1,3-thiazol-4-yl)methyl]aniline
CID 54864080
3-chloro-4-ethoxy-N-(3-methylcyclobutyl)aniline
CID 104860046
N'-(3-chloro-4-ethoxyphenyl)-N-ethylethane-1,2-diamine
CID 115205584
4-N-(3,4-dichlorophenyl)-2-ethoxybenzene-1,4-diamine
CID 63671293
6-(azetidin-3-yloxy)-N-[3-chloro-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]-7-ethoxyquinazolin-4-amine
CID 157047015

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride?
The IUPAC name of N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride (CID 135818936) is N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride.
What is the SMILES notation for N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride?
The canonical SMILES for N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride is CCOc1ccc(Nc2cc(C)[nH]c3ccc4ncnc4c23)cc1Cl.Cl.
What is the InChIKey of N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride?
The InChIKey is WWZRUPKRZFDNRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN4O.ClH/c1-3-25-17-7-4-12(9-13(17)20)24-16-8-11(2)23-14-5-6-15-19(18(14)16)22-10-21-15;/h4-10,23-24H,3H2,1-2H3;1H.
What are the key properties of N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride?
N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride has a molecular weight of 389.29 g/mol, XLogP of 5.64, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-ethoxyphenyl)-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine;hydrochloride is sourced from PubChem (CID 135818936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).