1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine

C19H29N3O — CID 10290

💊View drug profile → pamaquine
IUPAC1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine
SMILESCCN(CC)CCCC(C)Nc1cc(OC)cc2cccnc12
InChIInChI=1S/C19H29N3O/c1-5-22(6-2)12-8-9-15(3)21-18-14-17(23-4)13-16-10-7-11-20-19(16)18/h7,10-11,13-15,21H,5-6,8-9,12H2,1-4H3
InChIKeyQTQWMSOQOSJFBV-UHFFFAOYSA-N
MW315.46 g/mol
LogP4.17
Rot. Bonds9

About 1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine

1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine (PubChem CID 10290) has the molecular formula C19H29N3O and a molecular weight of 315.46 g/mol. Its IUPAC name is 1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine.

Molecular Properties

Compound Name1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine
PubChem CID10290
Molecular FormulaC19H29N3O
Molecular Weight315.46 g/mol
Exact Mass315.23
IUPAC Name1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine
SMILESCCN(CC)CCCC(C)Nc1cc(OC)cc2cccnc12
InChIInChI=1S/C19H29N3O/c1-5-22(6-2)12-8-9-15(3)21-18-14-17(23-4)13-16-10-7-11-20-19(16)18/h7,10-11,13-15,21H,5-6,8-9,12H2,1-4H3
InChIKeyQTQWMSOQOSJFBV-UHFFFAOYSA-N
XLogP4.17
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.46
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Primaquine
CID 4908
Sitamaquine
CID 42548
Primaquine Diphosphate
CID 6135
Quinocide
CID 68928
6,7-Dimethoxy-3-phenylquinoxaline
CID 2049
6-Methoxy-8-quinolinamine
CID 7023
(+)-Primaquine
CID 3044369
6-Methoxyquinoline
CID 14860
8-Aminoquinolin-6-ol
CID 244284
N-(6-Methoxy-8-quinolinyl)-4-methylbenzenesulfonamide
CID 130606
6-Methoxy-8-[(3-aminopropyl)amino]-4-methyl-5-(3-trifluoromethylphenyloxy)quinoline
CID 16048421
WR 242511
CID 133658

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine?
The IUPAC name of 1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine (CID 10290) is 1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine.
What is the SMILES notation for 1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine?
The canonical SMILES for 1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine is CCN(CC)CCCC(C)Nc1cc(OC)cc2cccnc12.
What is the InChIKey of 1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine?
The InChIKey is QTQWMSOQOSJFBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O/c1-5-22(6-2)12-8-9-15(3)21-18-14-17(23-4)13-16-10-7-11-20-19(16)18/h7,10-11,13-15,21H,5-6,8-9,12H2,1-4H3.
What are the key properties of 1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine?
1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine has a molecular weight of 315.46 g/mol, XLogP of 4.17, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine is sourced from PubChem (CID 10290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).