N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine

C23H27ClN4O — CID 10047213

IUPACN'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine
SMILESCOc1cc2c(cc1CN(C)CCCN(C)C)[nH]c1c3ccc(Cl)cc3ncc21
InChIInChI=1S/C23H27ClN4O/c1-27(2)8-5-9-28(3)14-15-10-21-18(12-22(15)29-4)19-13-25-20-11-16(24)6-7-17(20)23(19)26-21/h6-7,10-13,26H,5,8-9,14H2,1-4H3
InChIKeyFKIACNXEUIVKLX-UHFFFAOYSA-N
MW410.95 g/mol
LogP4.91
Rot. Bonds7

About N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine

N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine (PubChem CID 10047213) has the molecular formula C23H27ClN4O and a molecular weight of 410.95 g/mol. Its IUPAC name is N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine
PubChem CID10047213
Molecular FormulaC23H27ClN4O
Molecular Weight410.95 g/mol
Exact Mass410.19
IUPAC NameN'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine
SMILESCOc1cc2c(cc1CN(C)CCCN(C)C)[nH]c1c3ccc(Cl)cc3ncc21
InChIInChI=1S/C23H27ClN4O/c1-27(2)8-5-9-28(3)14-15-10-21-18(12-22(15)29-4)19-13-25-20-11-16(24)6-7-17(20)23(19)26-21/h6-7,10-13,26H,5,8-9,14H2,1-4H3
InChIKeyFKIACNXEUIVKLX-UHFFFAOYSA-N
XLogP4.91
TPSA44.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.95
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine with MolForge

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Related Compounds

(+-)-Quinacrine
CID 237
9-Methoxy-5,11-Dimethyl-6H-Pyrido(4,3-B)Carbazole
CID 72512
(R)-quinacrine
CID 446536
9-Methoxy-2-methylellipticinium acetate
CID 362973
6-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]hexanamide
CID 11555824
6-[(8-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]hexanamide
CID 11555826
7-[(6,8-dichloro-1,2,3,4-tetrahydroacridin-9-yl)amino]-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]heptanamide
CID 11563410
6-chloro-2-methoxy-N-(3-pyridyl)acridin-9-amine
CID 408350
3-(9-Methoxy-5,11-dimethylpyrido(4,3-b)carbazol-6-yl)propan-1-amine
CID 425818
(4-Aminobutyl)(3-aminopropyl){3-[(6-chloro-2-methyloxyacridin-9-yl)amino]propyl}amine
CID 470828
9-Methoxy-2,5,11-trimethyl-6H-pyrido(4,3-b)carbazolium iodide
CID 3086380
3-Chloro-8-methoxy-11H-indolo[3,2-c]quinoline
CID 5378164

Frequently Asked Questions

What is the IUPAC name of N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine?
The IUPAC name of N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine (CID 10047213) is N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine.
What is the SMILES notation for N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine?
The canonical SMILES for N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine is COc1cc2c(cc1CN(C)CCCN(C)C)[nH]c1c3ccc(Cl)cc3ncc21.
What is the InChIKey of N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine?
The InChIKey is FKIACNXEUIVKLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27ClN4O/c1-27(2)8-5-9-28(3)14-15-10-21-18(12-22(15)29-4)19-13-25-20-11-16(24)6-7-17(20)23(19)26-21/h6-7,10-13,26H,5,8-9,14H2,1-4H3.
What are the key properties of N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine?
N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine has a molecular weight of 410.95 g/mol, XLogP of 4.91, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(3-chloro-8-methoxy-11H-indolo[3,2-c]quinolin-9-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine is sourced from PubChem (CID 10047213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).