N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide

C149H153F8N19O13 — CID 167561728

IUPACN-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide
SMILESCCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(C)nc3)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(C)nc3C)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(F)nc3)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(F)nc3C)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(N)nc3)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(OC)nc3)cn2)c(F)c1
InChIInChI=1S/C26H28FN3O2.C25H25F2N3O2.C25H26FN3O3.C25H26FN3O2.C24H23F2N3O2.C24H25FN4O2/c1-5-26(32)30(4)16-19-7-11-22(23(27)14-19)24-12-9-21(15-28-24)25(31)13-10-20-8-6-17(2)29-18(20)3;1-4-25(32)30(3)15-17-5-9-20(21(26)13-17)22-10-6-19(14-28-22)23(31)11-7-18-8-12-24(27)29-16(18)2;1-4-25(31)29(2)16-18-5-9-20(21(26)13-18)22-10-8-19(15-27-22)23(30)11-6-17-7-12-24(32-3)28-14-17;1-4-25(31)29(3)16-19-7-10-21(22(26)13-19)23-11-9-20(15-28-23)24(30)12-8-18-6-5-17(2)27-14-18;2*1-3-24(31)29(2)15-17-4-8-19(20(25)12-17)21-9-7-18(14-27-21)22(30)10-5-16-6-11-23(26)28-13-16/h6-9,11-12,14-15H,5,10,13,16H2,1-4H3;5-6,8-10,12-14H,4,7,11,15H2,1-3H3;5,7-10,12-15H,4,6,11,16H2,1-3H3;5-7,9-11,13-15H,4,8,12,16H2,1-3H3;4,6-9,11-14H,3,5,10,15H2,1-2H3;4,6-9,11-14H,3,5,10,15H2,1-2H3,(H2,26,28)
InChIKeyDTBAJGMTTLOWIH-UHFFFAOYSA-N
MW2569.97 g/mol
LogP27.90
Rot. Bonds49

About N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide

N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide (PubChem CID 167561728) has the molecular formula C149H153F8N19O13 and a molecular weight of 2569.97 g/mol. Its IUPAC name is N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide.

Molecular Properties

Compound NameN-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide
PubChem CID167561728
Molecular FormulaC149H153F8N19O13
Molecular Weight2569.97 g/mol
Exact Mass2568.18
IUPAC NameN-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide
SMILESCCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(C)nc3)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(C)nc3C)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(F)nc3)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(F)nc3C)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(N)nc3)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(OC)nc3)cn2)c(F)c1
InChIInChI=1S/C26H28FN3O2.C25H25F2N3O2.C25H26FN3O3.C25H26FN3O2.C24H23F2N3O2.C24H25FN4O2/c1-5-26(32)30(4)16-19-7-11-22(23(27)14-19)24-12-9-21(15-28-24)25(31)13-10-20-8-6-17(2)29-18(20)3;1-4-25(32)30(3)15-17-5-9-20(21(26)13-17)22-10-6-19(14-28-22)23(31)11-7-18-8-12-24(27)29-16(18)2;1-4-25(31)29(2)16-18-5-9-20(21(26)13-18)22-10-8-19(15-27-22)23(30)11-6-17-7-12-24(32-3)28-14-17;1-4-25(31)29(3)16-19-7-10-21(22(26)13-19)23-11-9-20(15-28-23)24(30)12-8-18-6-5-17(2)27-14-18;2*1-3-24(31)29(2)15-17-4-8-19(20(25)12-17)21-9-7-18(14-27-21)22(30)10-5-16-6-11-23(26)28-13-16/h6-9,11-12,14-15H,5,10,13,16H2,1-4H3;5-6,8-10,12-14H,4,7,11,15H2,1-3H3;5,7-10,12-15H,4,6,11,16H2,1-3H3;5-7,9-11,13-15H,4,8,12,16H2,1-3H3;4,6-9,11-14H,3,5,10,15H2,1-2H3;4,6-9,11-14H,3,5,10,15H2,1-2H3,(H2,26,28)
InChIKeyDTBAJGMTTLOWIH-UHFFFAOYSA-N
XLogP27.90
TPSA414.21 Ų
H-Bond Donors1
H-Bond Acceptors26
Rotatable Bonds49
Heavy Atoms189
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002569.97
LogP ≤ 527.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide with MolForge

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Related Compounds

[4-(1-Aminoisoquinolin-7-yl)piperidin-1-yl]-[6-(6-methoxypyridin-3-yl)pyridin-3-yl]methanone;2,2,2-trifluoroacetic acid
CID 87303690
6-(dimethylamino)-N-[2-methyl-5-[4-[4-(trifluoromethyl)phenyl]piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide;6-(4-hydroxypiperidin-1-yl)-N-[5-[4-(4-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]pyridine-3-carboxamide
CID 87728291
2-fluoro-N-[1-[[6-[4-[(3-pyridin-3-ylbenzoyl)amino]piperidin-1-yl]pyridin-3-yl]methyl]piperidin-4-yl]-3-[6-(trifluoromethoxy)pyridin-3-yl]benzamide
CID 118155426
4-methyl-N-[1-[[6-[4-[(3-pyridin-3-ylbenzoyl)amino]piperidin-1-yl]pyridin-3-yl]methyl]piperidin-4-yl]-3-[6-(trifluoromethoxy)pyridin-3-yl]benzamide
CID 118155427
4-fluoro-N-[1-[[6-[4-[(3-pyridin-3-ylbenzoyl)amino]piperidin-1-yl]pyridin-3-yl]methyl]piperidin-4-yl]-3-[6-(trifluoromethoxy)pyridin-3-yl]benzamide
CID 118155428
7-[[[4-[4-[[4-Ethenyl-5-(methylideneamino)-6-oxopyrimidin-1-yl]methyl]-3-fluorophenyl]-2-pyridinyl]-methylamino]methyl]-3-[[2-fluoro-4-(2-methoxy-4-pyridinyl)phenyl]methyl]pyrido[3,2-d]pyrimidin-4-one
CID 123414913
N-[[4-[2-[[3-[[2,6-difluoro-4-(2-methoxy-4-pyridinyl)phenyl]methyl]-4-oxopyrido[3,2-d]pyrimidin-7-yl]methyl-methylamino]-4-pyridinyl]-2,6-difluorophenyl]methyl]-N-[(2-methyl-3-pyridinyl)iminomethyl]formamide
CID 123418379
3-[[2,6-Difluoro-4-(2-methoxy-4-pyridinyl)phenyl]methyl]-7-[[[4-[3,5-difluoro-4-[(4-oxopyrido[2,3-d]pyrimidin-3-yl)methyl]phenyl]-2-pyridinyl]-methylamino]methyl]pyrido[2,3-d]pyrimidin-4-one
CID 123779077
3-[[2-Fluoro-4-(2-methoxy-4-pyridinyl)phenyl]methyl]-7-[[[4-[3-fluoro-4-[(4-oxopyrido[2,3-d]pyrimidin-3-yl)methyl]phenyl]-2-pyridinyl]-methylamino]methyl]pyrido[2,3-d]pyrimidin-4-one
CID 123835760
5-(5-cyano-3-pyridinyl)-6-[2-hydroxyethyl(methyl)amino]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[ethyl(2-hydroxyethyl)amino]-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;5-(5-fluoro-3-pyridinyl)-6-[2-hydroxyethyl(methyl)amino]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[2-hydroxyethyl(methyl)amino]-5-(6-methyl-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[2-hydroxyethyl(methyl)amino]-5-pyridin-3-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[2-hydroxyethyl(methyl)amino]-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 157176480
5-(5-fluoro-6-methyl-3-pyridinyl)-6-(3-hydroxy-3-methylazetidin-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;5-(5-fluoro-3-pyridinyl)-6-(3-hydroxy-3-methylazetidin-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-hydroxyazetidin-1-yl)-5-(6-methyl-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-hydroxy-3-methylazetidin-1-yl)-5-(6-methyl-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-hydroxy-3-methylazetidin-1-yl)-5-pyridin-3-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-5-(6-methyl-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 157241206
(2-amino-3-pyridinyl)-[3-(2,2-difluoroethyl)-6-[(3S)-3-(2-methylpropyl)piperidin-1-yl]-2-pyridinyl]methanone;(2-amino-3-pyridinyl)-[6-[3-(3-methylphenyl)piperidin-1-yl]-3-(trifluoromethyl)-2-pyridinyl]methanone;(2-amino-3-pyridinyl)-[6-[(3S)-3-(2-methylpropyl)piperazin-1-yl]-3-[(Z)-prop-1-enyl]-2-pyridinyl]methanone;(2-amino-3-pyridinyl)-[6-[(3S)-3-(2-methylpropyl)piperazin-1-yl]-3-propyl-2-pyridinyl]methanone;3-[1-[6-[3-(3-methoxyphenyl)piperazin-1-yl]-3-(trifluoromethyl)-2-pyridinyl]ethenyl]pyridin-2-amine
CID 157420647

Frequently Asked Questions

What is the IUPAC name of N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide?
The IUPAC name of N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide (CID 167561728) is N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide.
What is the SMILES notation for N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide?
The canonical SMILES for N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide is CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(C)nc3)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(C)nc3C)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(F)nc3)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(F)nc3C)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(N)nc3)cn2)c(F)c1.CCC(=O)N(C)Cc1ccc(-c2ccc(C(=O)CCc3ccc(OC)nc3)cn2)c(F)c1.
What is the InChIKey of N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide?
The InChIKey is DTBAJGMTTLOWIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28FN3O2.C25H25F2N3O2.C25H26FN3O3.C25H26FN3O2.C24H23F2N3O2.C24H25FN4O2/c1-5-26(32)30(4)16-19-7-11-22(23(27)14-19)24-12-9-21(15-28-24)25(31)13-10-20-8-6-17(2)29-18(20)3;1-4-25(32)30(3)15-17-5-9-20(21(26)13-17)22-10-6-19(14-28-22)23(31)11-7-18-8-12-24(27)29-16(18)2;1-4-25(31)29(2)16-18-5-9-20(21(26)13-18)22-10-8-19(15-27-22)23(30)11-6-17-7-12-24(32-3)28-14-17;1-4-25(31)29(3)16-19-7-10-21(22(26)13-19)23-11-9-20(15-28-23)24(30)12-8-18-6-5-17(2)27-14-18;2*1-3-24(31)29(2)15-17-4-8-19(20(25)12-17)21-9-7-18(14-27-21)22(30)10-5-16-6-11-23(26)28-13-16/h6-9,11-12,14-15H,5,10,13,16H2,1-4H3;5-6,8-10,12-14H,4,7,11,15H2,1-3H3;5,7-10,12-15H,4,6,11,16H2,1-3H3;5-7,9-11,13-15H,4,8,12,16H2,1-3H3;4,6-9,11-14H,3,5,10,15H2,1-2H3;4,6-9,11-14H,3,5,10,15H2,1-2H3,(H2,26,28).
What are the key properties of N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide?
N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide has a molecular weight of 2569.97 g/mol, XLogP of 27.90, 49 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[5-[3-(6-amino-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[4-[5-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-pyridinyl]-3-fluorophenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-2-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methoxy-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide;N-[[3-fluoro-4-[5-[3-(6-methyl-3-pyridinyl)propanoyl]-2-pyridinyl]phenyl]methyl]-N-methylpropanamide is sourced from PubChem (CID 167561728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).