N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide

C153H199N15O10S — CID 161012202

IUPACN-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide
SMILESCCN(CC1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1cc2ccccc2s1.CCN(CC1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1ccccc1.CCN(CC1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1coc2ccccc12.CCc1cccc(CCN2CCCC(CN(CC)C(=O)C3=NC=CC3)C2)c1.CCc1cccc(CCN2CCCC(CN(CC)C(=O)C3=Nc4ccccc4C3)C2)c1.CCc1cccc(CCN2CCCC(CN(CC)C(=O)c3c[nH]c4ccccc34)C2)c1
InChIInChI=1S/2C27H35N3O.C26H32N2O3.C26H32N2O2S.C24H32N2O2.C23H33N3O/c1-3-21-9-7-10-22(17-21)14-16-29-15-8-11-23(19-29)20-30(4-2)27(31)25-18-28-26-13-6-5-12-24(25)26;1-3-21-9-7-10-22(17-21)14-16-29-15-8-11-23(19-29)20-30(4-2)27(31)26-18-24-12-5-6-13-25(24)28-26;1-3-28(26(29)24-19-31-25-12-5-4-11-23(24)25)18-21-9-7-14-27(17-21)15-13-20-8-6-10-22(16-20)30-2;1-3-28(26(29)25-17-22-10-4-5-12-24(22)31-25)19-21-9-7-14-27(18-21)15-13-20-8-6-11-23(16-20)30-2;1-3-26(24(27)22-11-5-4-6-12-22)19-21-10-8-15-25(18-21)16-14-20-9-7-13-23(17-20)28-2;1-3-19-8-5-9-20(16-19)12-15-25-14-7-10-21(17-25)18-26(4-2)23(27)22-11-6-13-24-22/h5-7,9-10,12-13,17-18,23,28H,3-4,8,11,14-16,19-20H2,1-2H3;5-7,9-10,12-13,17,23H,3-4,8,11,14-16,18-20H2,1-2H3;4-6,8,10-12,16,19,21H,3,7,9,13-15,17-18H2,1-2H3;4-6,8,10-12,16-17,21H,3,7,9,13-15,18-19H2,1-2H3;4-7,9,11-13,17,21H,3,8,10,14-16,18-19H2,1-2H3;5-6,8-9,13,16,21H,3-4,7,10-12,14-15,17-18H2,1-2H3
InChIKeyTXGOYRJFYJOBAQ-UHFFFAOYSA-N
MW2440.44 g/mol
LogP27.84
Rot. Bonds48

About N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide

N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide (PubChem CID 161012202) has the molecular formula C153H199N15O10S and a molecular weight of 2440.44 g/mol. Its IUPAC name is N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide
PubChem CID161012202
Molecular FormulaC153H199N15O10S
Molecular Weight2440.44 g/mol
Exact Mass2438.52
IUPAC NameN-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide
SMILESCCN(CC1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1cc2ccccc2s1.CCN(CC1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1ccccc1.CCN(CC1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1coc2ccccc12.CCc1cccc(CCN2CCCC(CN(CC)C(=O)C3=NC=CC3)C2)c1.CCc1cccc(CCN2CCCC(CN(CC)C(=O)C3=Nc4ccccc4C3)C2)c1.CCc1cccc(CCN2CCCC(CN(CC)C(=O)c3c[nH]c4ccccc34)C2)c1
InChIInChI=1S/2C27H35N3O.C26H32N2O3.C26H32N2O2S.C24H32N2O2.C23H33N3O/c1-3-21-9-7-10-22(17-21)14-16-29-15-8-11-23(19-29)20-30(4-2)27(31)25-18-28-26-13-6-5-12-24(25)26;1-3-21-9-7-10-22(17-21)14-16-29-15-8-11-23(19-29)20-30(4-2)27(31)26-18-24-12-5-6-13-25(24)28-26;1-3-28(26(29)24-19-31-25-12-5-4-11-23(24)25)18-21-9-7-14-27(17-21)15-13-20-8-6-10-22(16-20)30-2;1-3-28(26(29)25-17-22-10-4-5-12-24(22)31-25)19-21-9-7-14-27(18-21)15-13-20-8-6-11-23(16-20)30-2;1-3-26(24(27)22-11-5-4-6-12-22)19-21-10-8-15-25(18-21)16-14-20-9-7-13-23(17-20)28-2;1-3-19-8-5-9-20(16-19)12-15-25-14-7-10-21(17-25)18-26(4-2)23(27)22-11-6-13-24-22/h5-7,9-10,12-13,17-18,23,28H,3-4,8,11,14-16,19-20H2,1-2H3;5-7,9-10,12-13,17,23H,3-4,8,11,14-16,18-20H2,1-2H3;4-6,8,10-12,16,19,21H,3,7,9,13-15,17-18H2,1-2H3;4-6,8,10-12,16-17,21H,3,7,9,13-15,18-19H2,1-2H3;4-7,9,11-13,17,21H,3,8,10,14-16,18-19H2,1-2H3;5-6,8-9,13,16,21H,3-4,7,10-12,14-15,17-18H2,1-2H3
InChIKeyTXGOYRJFYJOBAQ-UHFFFAOYSA-N
XLogP27.84
TPSA222.64 Ų
H-Bond Donors1
H-Bond Acceptors19
Rotatable Bonds48
Heavy Atoms179
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002440.44
LogP ≤ 527.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1019

Analyze N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide with MolForge

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Related Compounds

N,N-diethyl-2-(3-ethylphenyl)furan-3-carboxamide;N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide;N,N-diethyl-2-(3-methoxyphenyl)furan-3-carboxamide;N,N-diethyl-4-methyl-2-phenylbenzamide;bis(N,N-diethyl-2-(4-methylphenyl)furan-3-carboxamide);N,N-diethyl-3-(4-methylphenyl)pyrazine-2-carboxamide;N,N-diethyl-3-(4-methylphenyl)pyridine-2-carboxamide;N,N-diethyl-2-phenylfuran-3-carboxamide;N,N-diethyl-2-phenyl-1H-indole-3-carboxamide;N,N-diethyl-2-[4-(trifluoromethyl)phenyl]furan-3-carboxamide;3-(4-fluorophenyl)-2-methylfuran
CID 158135434
2-[[2-[2-[2-[2-[4-(furan-2-yl)-3-thiophen-2-yl-1H-pyrrol-2-yl]-3-pyridinyl]-1H-indol-3-yl]-1-benzofuran-3-yl]phenyl]sulfanyl-phenylmethyl]-3-isoquinolin-1-ylquinoline
CID 91399156
2-[[2-[2-[2-[2-[3-(furan-2-yl)-5-naphthalen-1-yl-4-(1H-pyrrol-2-yl)-2-thiophen-2-ylphenyl]-3-pyridinyl]-1H-indol-3-yl]-1-benzofuran-3-yl]phenyl]sulfanyl-phenylmethyl]-3-isoquinolin-1-ylquinoline
CID 123289308
9-methylcarbazole;4-methyldibenzofuran;bis(4-methyldibenzothiophene);2-methylfuran;1-methylnaphthalene;bis(N-methyl-N-phenylaniline);1-methyl-3-phenylbenzene;3-(3-methylphenyl)pyridine;3-methylpyridine;4-methylpyridine;2-methyl-6-pyridin-3-ylpyridine;toluene
CID 157621377
4-Dibenzofuran-4-yl-2,6-dimethylpyridine;4-dibenzothiophen-4-yl-2,6-dimethylpyridine;2,6-dimethylpyridine;9-(2,6-dimethyl-4-pyridinyl)carbazole;2,6-dimethyl-4-pyridin-2-ylpyridine;2,6-dimethyl-4-pyridin-4-ylpyridine
CID 157805874
methane;2-propan-2-yl-1-benzofuran;3-propan-2-yl-1-benzofuran;2-propan-2-yl-1-benzothiophene;3-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indene;2-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-yl-1H-pyrrole;3-propan-2-ylquinoline;2-propan-2-ylthiophene
CID 157973826
N-[3-(1,2,3,4,6,7,8,9,10,10a-decahydropyrido[1,2-a]azepin-8-yl)-1-benzothiophen-5-yl]benzamide;N-[3-(1,2,3,5,6,7,8,8a-octahydroindolizin-7-yl)-1-benzofuran-5-yl]benzamide;N-[3-(2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-2-yl)-1H-indol-5-yl]benzamide
CID 158028979
(E)-2-[5-(aminomethyl)spiro[2H-1-benzofuran-3,4'-piperidine]-1'-carbonyl]-3-phenylprop-2-enenitrile;[5-(aminomethyl)spiro[2H-1-benzofuran-3,4'-piperidine]-1'-yl]-(7-methyl-1H-indol-3-yl)methanone;[5-(aminomethyl)spiro[2H-1-benzofuran-3,4'-piperidine]-1'-yl]-(5-methylsulfanylthiophen-2-yl)methanone
CID 159067969
(E)-3-(furan-3-yl)-1-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-ylprop-2-en-1-one;1H-indol-3-yl(spiro[1H-2-benzofuran-3,4'-piperidine]-1'-yl)methanone;(E)-3-pyridin-2-yl-1-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-ylprop-2-en-1-one;(E)-3-quinolin-3-yl-1-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-ylprop-2-en-1-one;(E)-1-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-yl-3-thiophen-2-ylprop-2-en-1-one;(E)-1-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-yl-3-thiophen-3-ylprop-2-en-1-one
CID 159084353
N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]cyclopenta-1,3-diene-1-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide
CID 159303423
N,N-diethyl-4-[[1-(furan-2-ylmethyl)piperidin-4-ylidene]-quinolin-8-ylmethyl]benzamide;N,N-diethyl-4-[[1-(furan-3-ylmethyl)piperidin-4-ylidene]-quinolin-8-ylmethyl]benzamide;N,N-diethyl-4-[piperidin-4-ylidene(quinolin-8-yl)methyl]benzamide;N,N-diethyl-4-[quinolin-8-yl-[1-(thiophen-2-ylmethyl)piperidin-4-ylidene]methyl]benzamide;furan-2-carbaldehyde;furan-3-carbaldehyde;thiophene-2-carbaldehyde
CID 159360643
2-Dibenzofuran-1-ylpyridine;2-dibenzofuran-2-ylpyridine;2-dibenzofuran-3-ylpyridine;2-dibenzofuran-4-ylpyridine;2-dibenzothiophen-1-ylpyridine;2-dibenzothiophen-4-ylpyridine;5-(2,6-dimethylphenyl)-2-phenylpyridine;4-methyl-2,5-diphenylpyridine;9-(2-methylpropyl)-1-pyridin-2-ylcarbazole;9-(2-methylpropyl)-2-pyridin-2-ylcarbazole
CID 159903097

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide?
The IUPAC name of N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide (CID 161012202) is N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide.
What is the SMILES notation for N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide?
The canonical SMILES for N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide is CCN(CC1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1cc2ccccc2s1.CCN(CC1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1ccccc1.CCN(CC1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1coc2ccccc12.CCc1cccc(CCN2CCCC(CN(CC)C(=O)C3=NC=CC3)C2)c1.CCc1cccc(CCN2CCCC(CN(CC)C(=O)C3=Nc4ccccc4C3)C2)c1.CCc1cccc(CCN2CCCC(CN(CC)C(=O)c3c[nH]c4ccccc34)C2)c1.
What is the InChIKey of N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide?
The InChIKey is TXGOYRJFYJOBAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C27H35N3O.C26H32N2O3.C26H32N2O2S.C24H32N2O2.C23H33N3O/c1-3-21-9-7-10-22(17-21)14-16-29-15-8-11-23(19-29)20-30(4-2)27(31)25-18-28-26-13-6-5-12-24(25)26;1-3-21-9-7-10-22(17-21)14-16-29-15-8-11-23(19-29)20-30(4-2)27(31)26-18-24-12-5-6-13-25(24)28-26;1-3-28(26(29)24-19-31-25-12-5-4-11-23(24)25)18-21-9-7-14-27(17-21)15-13-20-8-6-10-22(16-20)30-2;1-3-28(26(29)25-17-22-10-4-5-12-24(22)31-25)19-21-9-7-14-27(18-21)15-13-20-8-6-11-23(16-20)30-2;1-3-26(24(27)22-11-5-4-6-12-22)19-21-10-8-15-25(18-21)16-14-20-9-7-13-23(17-20)28-2;1-3-19-8-5-9-20(16-19)12-15-25-14-7-10-21(17-25)18-26(4-2)23(27)22-11-6-13-24-22/h5-7,9-10,12-13,17-18,23,28H,3-4,8,11,14-16,19-20H2,1-2H3;5-7,9-10,12-13,17,23H,3-4,8,11,14-16,18-20H2,1-2H3;4-6,8,10-12,16,19,21H,3,7,9,13-15,17-18H2,1-2H3;4-6,8,10-12,16-17,21H,3,7,9,13-15,18-19H2,1-2H3;4-7,9,11-13,17,21H,3,8,10,14-16,18-19H2,1-2H3;5-6,8-9,13,16,21H,3-4,7,10-12,14-15,17-18H2,1-2H3.
What are the key properties of N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide?
N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide has a molecular weight of 2440.44 g/mol, XLogP of 27.84, 48 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-3-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)ethyl]piperidin-3-yl]methyl]-3H-pyrrole-2-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]benzamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzofuran-3-carboxamide;N-ethyl-N-[[1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-benzothiophene-2-carboxamide is sourced from PubChem (CID 161012202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).