4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide

C125H145F2N11O7 — CID 157327267

IUPAC4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide
SMILESCC(=O)N(C)c1ccc(C(=C2CCNCC2)c2cccc(F)c2)cc1.CCN(CC)C(=O)c1ccc(C(=C2CCN(Cc3ccccc3)CC2)c2cccc(OC)c2)cc1.CCN(CC)C(=O)c1ccc(C(=C2CCNCC2)c2cccc(F)c2)cc1.CCN(CC)C(=O)c1ccc(C(=C2CCNCC2)c2cccc(OC)c2)cc1.CCN(CC)C(=O)c1ccc(C(=C2CCNCC2)c2cccc3cccnc23)cc1
InChIInChI=1S/C31H36N2O2.C26H29N3O.C24H30N2O2.C23H27FN2O.C21H23FN2O/c1-4-33(5-2)31(34)27-16-14-25(15-17-27)30(28-12-9-13-29(22-28)35-3)26-18-20-32(21-19-26)23-24-10-7-6-8-11-24;1-3-29(4-2)26(30)22-12-10-19(11-13-22)24(20-14-17-27-18-15-20)23-9-5-7-21-8-6-16-28-25(21)23;1-4-26(5-2)24(27)20-11-9-18(10-12-20)23(19-13-15-25-16-14-19)21-7-6-8-22(17-21)28-3;1-3-26(4-2)23(27)19-10-8-17(9-11-19)22(18-12-14-25-15-13-18)20-6-5-7-21(24)16-20;1-15(25)24(2)20-8-6-16(7-9-20)21(17-10-12-23-13-11-17)18-4-3-5-19(22)14-18/h6-17,22H,4-5,18-21,23H2,1-3H3;5-13,16,27H,3-4,14-15,17-18H2,1-2H3;6-12,17,25H,4-5,13-16H2,1-3H3;5-11,16,25H,3-4,12-15H2,1-2H3;3-9,14,23H,10-13H2,1-2H3
InChIKeyBEWMJEFFNLWCDW-UHFFFAOYSA-N
MW1951.60 g/mol
LogP24.03
Rot. Bonds27

About 4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide

4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide (PubChem CID 157327267) has the molecular formula C125H145F2N11O7 and a molecular weight of 1951.60 g/mol. Its IUPAC name is 4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide.

Molecular Properties

Compound Name4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide
PubChem CID157327267
Molecular FormulaC125H145F2N11O7
Molecular Weight1951.60 g/mol
Exact Mass1950.13
IUPAC Name4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide
SMILESCC(=O)N(C)c1ccc(C(=C2CCNCC2)c2cccc(F)c2)cc1.CCN(CC)C(=O)c1ccc(C(=C2CCN(Cc3ccccc3)CC2)c2cccc(OC)c2)cc1.CCN(CC)C(=O)c1ccc(C(=C2CCNCC2)c2cccc(F)c2)cc1.CCN(CC)C(=O)c1ccc(C(=C2CCNCC2)c2cccc(OC)c2)cc1.CCN(CC)C(=O)c1ccc(C(=C2CCNCC2)c2cccc3cccnc23)cc1
InChIInChI=1S/C31H36N2O2.C26H29N3O.C24H30N2O2.C23H27FN2O.C21H23FN2O/c1-4-33(5-2)31(34)27-16-14-25(15-17-27)30(28-12-9-13-29(22-28)35-3)26-18-20-32(21-19-26)23-24-10-7-6-8-11-24;1-3-29(4-2)26(30)22-12-10-19(11-13-22)24(20-14-17-27-18-15-20)23-9-5-7-21-8-6-16-28-25(21)23;1-4-26(5-2)24(27)20-11-9-18(10-12-20)23(19-13-15-25-16-14-19)21-7-6-8-22(17-21)28-3;1-3-26(4-2)23(27)19-10-8-17(9-11-19)22(18-12-14-25-15-13-18)20-6-5-7-21(24)16-20;1-15(25)24(2)20-8-6-16(7-9-20)21(17-10-12-23-13-11-17)18-4-3-5-19(22)14-18/h6-17,22H,4-5,18-21,23H2,1-3H3;5-13,16,27H,3-4,14-15,17-18H2,1-2H3;6-12,17,25H,4-5,13-16H2,1-3H3;5-11,16,25H,3-4,12-15H2,1-2H3;3-9,14,23H,10-13H2,1-2H3
InChIKeyBEWMJEFFNLWCDW-UHFFFAOYSA-N
XLogP24.03
TPSA184.26 Ų
H-Bond Donors4
H-Bond Acceptors13
Rotatable Bonds27
Heavy Atoms145
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001951.60
LogP ≤ 524.03
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1013

Analyze 4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide with MolForge

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Related Compounds

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Biarylether amide quinoline, 4c
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N-[2-[[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]carbamoyl]-5-fluorophenyl]quinoline-3-carboxamide
CID 15511442
N-[4-(difluoromethoxy)phenyl]-6-methyl-2-pyridin-4-ylquinoline-4-carboxamide
CID 1261372
[4-(3-Methoxybenzyl)piperazin-1-yl][6-methyl-2-(pyridin-4-yl)quinolin-4-yl]methanone
CID 1261545
N-(trans-4-(2-(8-methoxy-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-3-yl)ethyl)cyclohexyl)quinoline-4-carboxamide
CID 44406616
N-(trans-4-(2-(8-methoxy-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-3-yl)ethyl)cyclohexyl)quinoline-3-carboxamide
CID 44406640
N-(trans-4-(2-(8-methoxy-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-3-yl)ethyl)cyclohexyl)isoquinoline-3-carboxamide
CID 44406647
N-(trans-4-(2-(8-methoxy-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-3-yl)ethyl)cyclohexyl)quinoline-6-carboxamide
CID 44406717

Frequently Asked Questions

What is the IUPAC name of 4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide?
The IUPAC name of 4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide (CID 157327267) is 4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide.
What is the SMILES notation for 4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide?
The canonical SMILES for 4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide is CC(=O)N(C)c1ccc(C(=C2CCNCC2)c2cccc(F)c2)cc1.CCN(CC)C(=O)c1ccc(C(=C2CCN(Cc3ccccc3)CC2)c2cccc(OC)c2)cc1.CCN(CC)C(=O)c1ccc(C(=C2CCNCC2)c2cccc(F)c2)cc1.CCN(CC)C(=O)c1ccc(C(=C2CCNCC2)c2cccc(OC)c2)cc1.CCN(CC)C(=O)c1ccc(C(=C2CCNCC2)c2cccc3cccnc23)cc1.
What is the InChIKey of 4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide?
The InChIKey is BEWMJEFFNLWCDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H36N2O2.C26H29N3O.C24H30N2O2.C23H27FN2O.C21H23FN2O/c1-4-33(5-2)31(34)27-16-14-25(15-17-27)30(28-12-9-13-29(22-28)35-3)26-18-20-32(21-19-26)23-24-10-7-6-8-11-24;1-3-29(4-2)26(30)22-12-10-19(11-13-22)24(20-14-17-27-18-15-20)23-9-5-7-21-8-6-16-28-25(21)23;1-4-26(5-2)24(27)20-11-9-18(10-12-20)23(19-13-15-25-16-14-19)21-7-6-8-22(17-21)28-3;1-3-26(4-2)23(27)19-10-8-17(9-11-19)22(18-12-14-25-15-13-18)20-6-5-7-21(24)16-20;1-15(25)24(2)20-8-6-16(7-9-20)21(17-10-12-23-13-11-17)18-4-3-5-19(22)14-18/h6-17,22H,4-5,18-21,23H2,1-3H3;5-13,16,27H,3-4,14-15,17-18H2,1-2H3;6-12,17,25H,4-5,13-16H2,1-3H3;5-11,16,25H,3-4,12-15H2,1-2H3;3-9,14,23H,10-13H2,1-2H3.
What are the key properties of 4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide?
4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide has a molecular weight of 1951.60 g/mol, XLogP of 24.03, 27 rotatable bonds, 4 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-benzylpiperidin-4-ylidene)-(3-methoxyphenyl)methyl]-N,N-diethylbenzamide;N,N-diethyl-4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[(3-methoxyphenyl)-piperidin-4-ylidenemethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N-[4-[(3-fluorophenyl)-piperidin-4-ylidenemethyl]phenyl]-N-methylacetamide is sourced from PubChem (CID 157327267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).