4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine

C18H20N4O — CID 168795672

IUPAC4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine
SMILESCOCc1ccc(Nc2ccnc3ccc(N(C)C)cc23)cn1
InChIInChI=1S/C18H20N4O/c1-22(2)15-6-7-17-16(10-15)18(8-9-19-17)21-13-4-5-14(12-23-3)20-11-13/h4-11H,12H2,1-3H3,(H,19,21)
InChIKeyVOUXNEPLWLZVKJ-UHFFFAOYSA-N
MW308.39 g/mol
LogP3.59
Rot. Bonds5

About 4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine

4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine (PubChem CID 168795672) has the molecular formula C18H20N4O and a molecular weight of 308.39 g/mol. Its IUPAC name is 4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine.

Molecular Properties

Compound Name4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine
PubChem CID168795672
Molecular FormulaC18H20N4O
Molecular Weight308.39 g/mol
Exact Mass308.16
IUPAC Name4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine
SMILESCOCc1ccc(Nc2ccnc3ccc(N(C)C)cc23)cn1
InChIInChI=1S/C18H20N4O/c1-22(2)15-6-7-17-16(10-15)18(8-9-19-17)21-13-4-5-14(12-23-3)20-11-13/h4-11H,12H2,1-3H3,(H,19,21)
InChIKeyVOUXNEPLWLZVKJ-UHFFFAOYSA-N
XLogP3.59
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine with MolForge

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Related Compounds

4-[[6-(dimethylamino)quinolin-4-yl]amino]benzaldehyde
CID 157043577
6-N,6-N-dimethyl-4-N-propylquinoline-4,6-diamine
CID 55045574
4-methoxy-N,N-dimethylquinolin-6-amine
CID 157042980
N-[4-[[6-(dimethylamino)quinolin-4-yl]amino]phenyl]benzamide
CID 142700397
N-(5-anilino-2-pyridinyl)-6-[[6-(dimethylamino)quinolin-4-yl]amino]pyridine-3-carboxamide
CID 157044230
N-[4-[[6-(dimethylamino)quinolin-4-yl]amino]phenyl]-4-[(1-methylpyridin-1-ium-4-yl)amino]benzamide chloride
CID 71659966
N-(4-fluorophenyl)-6-(methoxymethyl)pyridin-3-amine
CID 91597555
6-N,6-N-dimethyl-4-N-[4-[6-[(2-methyl-4-pyridinyl)methyl]-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]quinoline-4,6-diamine
CID 174087050
6-N,6-N-dimethyl-4-N-[4-[5-[(2-methyl-4-pyridinyl)methyl]-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]quinoline-4,6-diamine
CID 174087071
2-(methoxymethyl)-6-N,6-N-dimethylquinoline-4,6-diamine
CID 55062590
6-N,6-N-dimethylquinoline-4,6-diamine
CID 62190283
6-[[6-(dimethylamino)quinolin-4-yl]amino]-N-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]pyridine-3-carboxamide
CID 157044051

Frequently Asked Questions

What is the IUPAC name of 4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine?
The IUPAC name of 4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine (CID 168795672) is 4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine.
What is the SMILES notation for 4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine?
The canonical SMILES for 4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine is COCc1ccc(Nc2ccnc3ccc(N(C)C)cc23)cn1.
What is the InChIKey of 4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine?
The InChIKey is VOUXNEPLWLZVKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O/c1-22(2)15-6-7-17-16(10-15)18(8-9-19-17)21-13-4-5-14(12-23-3)20-11-13/h4-11H,12H2,1-3H3,(H,19,21).
What are the key properties of 4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine?
4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine has a molecular weight of 308.39 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[6-(methoxymethyl)-3-pyridinyl]-6-N,6-N-dimethylquinoline-4,6-diamine is sourced from PubChem (CID 168795672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).