2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene

C88H151F3N22O2 — CID 159479533

IUPAC2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene
SMILESCN(C)CCc1cccc(CCN(C)C)n1.CN(C)Cc1cc(=O)cc(CN(C)C)[nH]1.CN(C)Cc1cc(C(F)(F)F)cc(CN(C)C)n1.CN(C)Cc1cncc(CN(C)C)n1.CN1CCCCCCCCCN(C)Cc2cccc(n2)C1.COc1cc(CN(C)C)nc(CN(C)C)c1.Cc1cc(CN(C)C)nc(CN(C)C)c1
InChIInChI=1S/C18H31N3.C13H23N3.C12H18F3N3.C12H21N3O.C12H21N3.C11H19N3O.C10H18N4/c1-20-13-8-6-4-3-5-7-9-14-21(2)16-18-12-10-11-17(15-20)19-18;1-15(2)10-8-12-6-5-7-13(14-12)9-11-16(3)4;1-17(2)7-10-5-9(12(13,14)15)6-11(16-10)8-18(3)4;1-14(2)8-10-6-12(16-5)7-11(13-10)9-15(3)4;1-10-6-11(8-14(2)3)13-12(7-10)9-15(4)5;1-13(2)7-9-5-11(15)6-10(12-9)8-14(3)4;1-13(2)7-9-5-11-6-10(12-9)8-14(3)4/h10-12H,3-9,13-16H2,1-2H3;5-7H,8-11H2,1-4H3;5-6H,7-8H2,1-4H3;6-7H,8-9H2,1-5H3;6-7H,8-9H2,1-5H3;5-6H,7-8H2,1-4H3,(H,12,15);5-6H,7-8H2,1-4H3
InChIKeyLWVBQYHHQOOORS-UHFFFAOYSA-N
MW1606.32 g/mol
LogP11.03
Rot. Bonds27

About 2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene

2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene (PubChem CID 159479533) has the molecular formula C88H151F3N22O2 and a molecular weight of 1606.32 g/mol. Its IUPAC name is 2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene.

Molecular Properties

Compound Name2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene
PubChem CID159479533
Molecular FormulaC88H151F3N22O2
Molecular Weight1606.32 g/mol
Exact Mass1605.23
IUPAC Name2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene
SMILESCN(C)CCc1cccc(CCN(C)C)n1.CN(C)Cc1cc(=O)cc(CN(C)C)[nH]1.CN(C)Cc1cc(C(F)(F)F)cc(CN(C)C)n1.CN(C)Cc1cncc(CN(C)C)n1.CN1CCCCCCCCCN(C)Cc2cccc(n2)C1.COc1cc(CN(C)C)nc(CN(C)C)c1.Cc1cc(CN(C)C)nc(CN(C)C)c1
InChIInChI=1S/C18H31N3.C13H23N3.C12H18F3N3.C12H21N3O.C12H21N3.C11H19N3O.C10H18N4/c1-20-13-8-6-4-3-5-7-9-14-21(2)16-18-12-10-11-17(15-20)19-18;1-15(2)10-8-12-6-5-7-13(14-12)9-11-16(3)4;1-17(2)7-10-5-9(12(13,14)15)6-11(16-10)8-18(3)4;1-14(2)8-10-6-12(16-5)7-11(13-10)9-15(3)4;1-10-6-11(8-14(2)3)13-12(7-10)9-15(4)5;1-13(2)7-9-5-11(15)6-10(12-9)8-14(3)4;1-13(2)7-9-5-11-6-10(12-9)8-14(3)4/h10-12H,3-9,13-16H2,1-2H3;5-7H,8-11H2,1-4H3;5-6H,7-8H2,1-4H3;6-7H,8-9H2,1-5H3;6-7H,8-9H2,1-5H3;5-6H,7-8H2,1-4H3,(H,12,15);5-6H,7-8H2,1-4H3
InChIKeyLWVBQYHHQOOORS-UHFFFAOYSA-N
XLogP11.03
TPSA177.68 Ų
H-Bond Donors1
H-Bond Acceptors23
Rotatable Bonds27
Heavy Atoms115
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001606.32
LogP ≤ 511.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1023

Analyze 2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Isoquinolin-1-ylisoquinoline;4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;5-(trifluoromethyl)-2-[5-(trifluoromethyl)-2-pyridinyl]pyridine
CID 158765086
2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[4-[(dimethylamino)methyl]-1,3,5-triazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene
CID 159561549
2-Ethyl-4-methoxy-3,5-dimethylpyridine;2-ethyl-4-methoxy-3-methylpyridine;2-ethyl-3-methylpyridine;2-ethyl-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine;2-ethylpyridine
CID 160181531
N,N,N',N'-tetrakis[[3-methyl-4-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]ethane-1,2-diamine
CID 101464002
Bis(2-(2,4-difluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine);iridium(3+);4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine;hexafluorophosphate
CID 171703478
Bis(2-[2-fluoro-4-(trifluoromethyl)benzene-6-id-1-yl]-5-(trifluoromethyl)pyridine);iridium(3+);4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine;hexafluorophosphate
CID 171703479
[IR(DF(CF3)Ppy)2(4,4'-(ome)2bpy]BF4
CID 177929893
Bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine);4-methyl-2-(4-methyl-2-pyridinyl)pyridine;osmium
CID 15678351
4-Methoxy-2-(4-methoxy-2-pyridinyl)pyridine;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);osmium
CID 15678352
6-{[(4-Methoxy-3,5-dimethyl-pyridin-2-ylmethyl)-methyl-amino]-methyl}-4'-(4-methyl-piperazin-1-yl)-[2,2]bipyridinyl-4-ol
CID 57577948
Bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine);4-methyl-2-(4-methyl-2-pyridinyl)pyridine
CID 67748270
4-Methoxy-2-(4-methoxy-2-pyridinyl)pyridine;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)
CID 67748276

Frequently Asked Questions

What is the IUPAC name of 2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene?
The IUPAC name of 2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene (CID 159479533) is 2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene.
What is the SMILES notation for 2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene?
The canonical SMILES for 2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene is CN(C)CCc1cccc(CCN(C)C)n1.CN(C)Cc1cc(=O)cc(CN(C)C)[nH]1.CN(C)Cc1cc(C(F)(F)F)cc(CN(C)C)n1.CN(C)Cc1cncc(CN(C)C)n1.CN1CCCCCCCCCN(C)Cc2cccc(n2)C1.COc1cc(CN(C)C)nc(CN(C)C)c1.Cc1cc(CN(C)C)nc(CN(C)C)c1.
What is the InChIKey of 2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene?
The InChIKey is LWVBQYHHQOOORS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3.C13H23N3.C12H18F3N3.C12H21N3O.C12H21N3.C11H19N3O.C10H18N4/c1-20-13-8-6-4-3-5-7-9-14-21(2)16-18-12-10-11-17(15-20)19-18;1-15(2)10-8-12-6-5-7-13(14-12)9-11-16(3)4;1-17(2)7-10-5-9(12(13,14)15)6-11(16-10)8-18(3)4;1-14(2)8-10-6-12(16-5)7-11(13-10)9-15(3)4;1-10-6-11(8-14(2)3)13-12(7-10)9-15(4)5;1-13(2)7-9-5-11(15)6-10(12-9)8-14(3)4;1-13(2)7-9-5-11-6-10(12-9)8-14(3)4/h10-12H,3-9,13-16H2,1-2H3;5-7H,8-11H2,1-4H3;5-6H,7-8H2,1-4H3;6-7H,8-9H2,1-5H3;6-7H,8-9H2,1-5H3;5-6H,7-8H2,1-4H3,(H,12,15);5-6H,7-8H2,1-4H3.
What are the key properties of 2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene?
2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene has a molecular weight of 1606.32 g/mol, XLogP of 11.03, 27 rotatable bonds, 1 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis[(dimethylamino)methyl]-1H-pyridin-4-one;2-[6-[2-(dimethylamino)ethyl]-2-pyridinyl]-N,N-dimethylethanamine;1-[6-[(dimethylamino)methyl]-4-methoxy-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-methyl-2-pyridinyl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]pyrazin-2-yl]-N,N-dimethylmethanamine;1-[6-[(dimethylamino)methyl]-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylmethanamine;3,13-dimethyl-3,13,19-triazabicyclo[13.3.1]nonadeca-1(19),15,17-triene is sourced from PubChem (CID 159479533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).