(E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide

C139H150N12O15S9 — CID 159795952

IUPAC(E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide
SMILESCCN(Cc1cccs1)C(=O)/C=C/c1ccc(O)cc1.CCN(Cc1cccs1)C(=O)/C=C/c1ccc(OC)cc1.CCN(Cc1cccs1)C(=O)/C=C/c1cccc(O)c1.CCN(Cc1cccs1)C(=O)/C=C/c1ccccc1OC.CCN(Cc1cccs1)C(=O)/C=C/c1ccccn1.CCN(Cc1cccs1)C(=O)/C=C/c1cccnc1.CCN(Cc1cccs1)C(=O)/C=C/c1ccco1.CCN(Cc1cccs1)C(=O)/C=C/c1ccncc1.CCN(Cc1cccs1)C(=O)/C=C/c1ccoc1
InChIInChI=1S/2C17H19NO2S.2C16H17NO2S.3C15H16N2OS.2C14H15NO2S/c1-3-18(13-16-5-4-12-21-16)17(19)11-8-14-6-9-15(20-2)10-7-14;1-3-18(13-15-8-6-12-21-15)17(19)11-10-14-7-4-5-9-16(14)20-2;1-2-17(12-15-7-4-10-20-15)16(19)9-8-13-5-3-6-14(18)11-13;1-2-17(12-15-4-3-11-20-15)16(19)10-7-13-5-8-14(18)9-6-13;1-2-17(12-14-6-4-10-19-14)15(18)8-7-13-5-3-9-16-11-13;1-2-17(12-14-4-3-11-19-14)15(18)6-5-13-7-9-16-10-8-13;1-2-17(12-14-7-5-11-19-14)15(18)9-8-13-6-3-4-10-16-13;1-2-15(11-13-6-4-10-18-13)14(16)8-7-12-5-3-9-17-12;1-2-15(10-13-4-3-9-18-13)14(16)6-5-12-7-8-17-11-12/h2*4-12H,3,13H2,1-2H3;2*3-11,18H,2,12H2,1H3;3*3-11H,2,12H2,1H3;3-10H,2,11H2,1H3;3-9,11H,2,10H2,1H3/b11-8+;11-10+;9-8+;10-7+;8-7+;6-5+;9-8+;8-7+;6-5+
InChIKeyNJEFHVJWRVIXPK-MDXPAQSUSA-N
MW2517.40 g/mol
LogP31.09
Rot. Bonds47

About (E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide

(E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide (PubChem CID 159795952) has the molecular formula C139H150N12O15S9 and a molecular weight of 2517.40 g/mol. Its IUPAC name is (E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide
PubChem CID159795952
Molecular FormulaC139H150N12O15S9
Molecular Weight2517.40 g/mol
Exact Mass2514.88
IUPAC Name(E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide
SMILESCCN(Cc1cccs1)C(=O)/C=C/c1ccc(O)cc1.CCN(Cc1cccs1)C(=O)/C=C/c1ccc(OC)cc1.CCN(Cc1cccs1)C(=O)/C=C/c1cccc(O)c1.CCN(Cc1cccs1)C(=O)/C=C/c1ccccc1OC.CCN(Cc1cccs1)C(=O)/C=C/c1ccccn1.CCN(Cc1cccs1)C(=O)/C=C/c1cccnc1.CCN(Cc1cccs1)C(=O)/C=C/c1ccco1.CCN(Cc1cccs1)C(=O)/C=C/c1ccncc1.CCN(Cc1cccs1)C(=O)/C=C/c1ccoc1
InChIInChI=1S/2C17H19NO2S.2C16H17NO2S.3C15H16N2OS.2C14H15NO2S/c1-3-18(13-16-5-4-12-21-16)17(19)11-8-14-6-9-15(20-2)10-7-14;1-3-18(13-15-8-6-12-21-15)17(19)11-10-14-7-4-5-9-16(14)20-2;1-2-17(12-15-7-4-10-20-15)16(19)9-8-13-5-3-6-14(18)11-13;1-2-17(12-15-4-3-11-20-15)16(19)10-7-13-5-8-14(18)9-6-13;1-2-17(12-14-6-4-10-19-14)15(18)8-7-13-5-3-9-16-11-13;1-2-17(12-14-4-3-11-19-14)15(18)6-5-13-7-9-16-10-8-13;1-2-17(12-14-7-5-11-19-14)15(18)9-8-13-6-3-4-10-16-13;1-2-15(11-13-6-4-10-18-13)14(16)8-7-12-5-3-9-17-12;1-2-15(10-13-4-3-9-18-13)14(16)6-5-12-7-8-17-11-12/h2*4-12H,3,13H2,1-2H3;2*3-11,18H,2,12H2,1H3;3*3-11H,2,12H2,1H3;3-10H,2,11H2,1H3;3-9,11H,2,10H2,1H3/b11-8+;11-10+;9-8+;10-7+;8-7+;6-5+;9-8+;8-7+;6-5+
InChIKeyNJEFHVJWRVIXPK-MDXPAQSUSA-N
XLogP31.09
TPSA306.66 Ų
H-Bond Donors2
H-Bond Acceptors27
Rotatable Bonds47
Heavy Atoms175
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002517.40
LogP ≤ 531.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide with MolForge

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Related Compounds

5-[2-[1-[5-(2,3-dihydro-1H-inden-5-yl)-4-hydroxythiophen-3-yl]ethylideneamino]acetyl]-N,N-diethylthiophene-2-carboxamide;1-[5-[2-[1-[5-(2,3-dihydro-1H-inden-5-yl)-4-hydroxythiophen-3-yl]ethylideneamino]acetyl]thiophen-2-yl]-4-pyridin-4-ylbutan-1-one;1-[5-[2-[1-[5-(2,3-dihydro-1H-inden-5-yl)-4-hydroxythiophen-3-yl]ethylideneamino]acetyl]thiophen-2-yl]-3-pyridin-4-ylpropan-1-one;2-[1-[5-(2,3-dihydro-1H-inden-5-yl)-4-hydroxythiophen-3-yl]ethylideneamino]-1-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]ethanone;methyl 4-[2-[1-[5-(2,3-dihydro-1-benzofuran-5-yl)-4-hydroxythiophen-3-yl]ethylideneamino]acetyl]benzoate;methyl 5-[2-[1-[5-(2,3-dihydro-1-benzofuran-5-yl)-4-hydroxythiophen-3-yl]ethylideneamino]acetyl]thiophene-2-carboxylate
CID 157228943
6-[2-[[[4-(Furan-2-yl)benzoyl]-(2-pyridin-2-ylethyl)amino]methyl]phenoxy]hexanoic acid;6-[2-[[[4-(furan-3-yl)benzoyl]-(2-pyridin-2-ylethyl)amino]methyl]phenoxy]hexanoic acid;6-[2-[[2-pyridin-2-ylethyl-(4-thiophen-2-ylbenzoyl)amino]methyl]phenoxy]hexanoic acid;6-[2-[[2-pyridin-2-ylethyl-(4-thiophen-3-ylbenzoyl)amino]methyl]phenoxy]hexanoic acid
CID 157315067
(E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxy-4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide
CID 157358448
N,3-dimethyl-4-oxo-6-pyridin-2-yl-7H-thieno[3,2-c]pyridine-2-carboxamide;3-ethyl-2-methyl-6-pyridin-2-yl-7H-thieno[3,2-c]pyridin-4-one;3-(furan-2-yl)-6-pyridin-2-yl-7H-thieno[3,2-c]pyridin-4-one;3-(2-methylpropyl)-6-pyridin-2-yl-7H-thieno[3,2-c]pyridin-4-one;2-phenyl-6-pyridin-2-yl-7H-thieno[3,2-c]pyridin-4-one;N,N,3-trimethyl-4-oxo-6-pyridin-2-yl-7H-thieno[3,2-c]pyridine-2-carboxamide
CID 157448608
6-[2-[Deuterio-[[4-(furan-3-yl)benzoyl]-(3-morpholin-4-ylpropyl)amino]methyl]phenoxy]hexanoic acid;6-[2-[deuterio-[3-morpholin-4-ylpropyl-(4-thiophen-2-ylbenzoyl)amino]methyl]phenoxy]hexanoic acid;6-[2-[deuterio-[3-morpholin-4-ylpropyl-(4-thiophen-3-ylbenzoyl)amino]methyl]phenoxy]hexanoic acid;6-[2-[deuterio-[(4-phenylbenzoyl)-(2-pyridin-2-ylethyl)amino]methyl]phenoxy]hexanoic acid
CID 157513581
6-[2-[Deuterio-[[4-(furan-2-yl)benzoyl]-(2-pyridin-2-ylethyl)amino]methyl]phenoxy]hexanoic acid;6-[2-[deuterio-[[4-(furan-3-yl)benzoyl]-(2-pyridin-2-ylethyl)amino]methyl]phenoxy]hexanoic acid;6-[2-[deuterio-[(4-phenylbenzoyl)-propan-2-ylamino]methyl]phenoxy]hexanoic acid;6-[2-[deuterio-[2-pyridin-2-ylethyl-(4-thiophen-2-ylbenzoyl)amino]methyl]phenoxy]hexanoic acid;6-[2-[deuterio-[2-pyridin-2-ylethyl-(4-thiophen-3-ylbenzoyl)amino]methyl]phenoxy]hexanoic acid
CID 157724099
Cumene;methane;2-propan-2-ylfuran;3-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylthiophene;3-propan-2-ylthiophene
CID 157836986
6-[2-[[2-Deuteriopropan-2-yl-[5-(furan-2-yl)pyridine-2-carbonyl]amino]methyl]phenoxy]hexanoic acid;6-[2-[[2-deuteriopropan-2-yl-[6-(furan-2-yl)pyridine-3-carbonyl]amino]methyl]phenoxy]hexanoic acid;6-[2-[[2-deuteriopropan-2-yl-[5-(furan-2-yl)thiophene-2-carbonyl]amino]methyl]phenoxy]hexanoic acid;6-[2-[dideuterio-[[6-(furan-2-yl)pyridine-3-carbonyl]-propan-2-ylamino]methyl]phenoxy]hexanoic acid;6-[2-[dideuterio-[[5-(furan-2-yl)thiophene-2-carbonyl]-propan-2-ylamino]methyl]phenoxy]hexanoic acid
CID 157859957
6-[2-[Deuterio-[(4-phenylbenzoyl)-propan-2-ylamino]methyl]phenoxy]hexanoic acid;6-[2-[deuterio-[2-pyridin-2-ylethyl-(4-thiophen-2-ylbenzoyl)amino]methyl]phenoxy]hexanoic acid;6-[2-[deuterio-[2-pyridin-2-ylethyl-(4-thiophen-3-ylbenzoyl)amino]methyl]phenoxy]hexanoic acid
CID 158092446
6-[2-[Deuterio-[[4-(furan-3-yl)benzoyl]-(2-pyridin-2-ylethyl)amino]methyl]phenoxy]hexanoic acid;6-[2-[deuterio-[(4-phenylbenzoyl)-propan-2-ylamino]methyl]phenoxy]hexanoic acid;6-[2-[deuterio-[2-pyridin-2-ylethyl-(4-thiophen-2-ylbenzoyl)amino]methyl]phenoxy]hexanoic acid;6-[2-[deuterio-[2-pyridin-2-ylethyl-(4-thiophen-3-ylbenzoyl)amino]methyl]phenoxy]hexanoic acid
CID 158343990
Cumene;2-propan-2-ylfuran;3-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylthiophene;3-propan-2-ylthiophene
CID 158359153
cumene;2-methylpropane;2-propan-2-ylfuran;3-propan-2-ylfuran;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylthiophene;3-propan-2-ylthiophene;1H-pyridin-2-one
CID 158415528

Frequently Asked Questions

What is the IUPAC name of (E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide?
The IUPAC name of (E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide (CID 159795952) is (E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide.
What is the SMILES notation for (E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide?
The canonical SMILES for (E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide is CCN(Cc1cccs1)C(=O)/C=C/c1ccc(O)cc1.CCN(Cc1cccs1)C(=O)/C=C/c1ccc(OC)cc1.CCN(Cc1cccs1)C(=O)/C=C/c1cccc(O)c1.CCN(Cc1cccs1)C(=O)/C=C/c1ccccc1OC.CCN(Cc1cccs1)C(=O)/C=C/c1ccccn1.CCN(Cc1cccs1)C(=O)/C=C/c1cccnc1.CCN(Cc1cccs1)C(=O)/C=C/c1ccco1.CCN(Cc1cccs1)C(=O)/C=C/c1ccncc1.CCN(Cc1cccs1)C(=O)/C=C/c1ccoc1.
What is the InChIKey of (E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide?
The InChIKey is NJEFHVJWRVIXPK-MDXPAQSUSA-N. The full InChI is InChI=1S/2C17H19NO2S.2C16H17NO2S.3C15H16N2OS.2C14H15NO2S/c1-3-18(13-16-5-4-12-21-16)17(19)11-8-14-6-9-15(20-2)10-7-14;1-3-18(13-15-8-6-12-21-15)17(19)11-10-14-7-4-5-9-16(14)20-2;1-2-17(12-15-7-4-10-20-15)16(19)9-8-13-5-3-6-14(18)11-13;1-2-17(12-15-4-3-11-20-15)16(19)10-7-13-5-8-14(18)9-6-13;1-2-17(12-14-6-4-10-19-14)15(18)8-7-13-5-3-9-16-11-13;1-2-17(12-14-4-3-11-19-14)15(18)6-5-13-7-9-16-10-8-13;1-2-17(12-14-7-5-11-19-14)15(18)9-8-13-6-3-4-10-16-13;1-2-15(11-13-6-4-10-18-13)14(16)8-7-12-5-3-9-17-12;1-2-15(10-13-4-3-9-18-13)14(16)6-5-12-7-8-17-11-12/h2*4-12H,3,13H2,1-2H3;2*3-11,18H,2,12H2,1H3;3*3-11H,2,12H2,1H3;3-10H,2,11H2,1H3;3-9,11H,2,10H2,1H3/b11-8+;11-10+;9-8+;10-7+;8-7+;6-5+;9-8+;8-7+;6-5+.
What are the key properties of (E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide?
(E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide has a molecular weight of 2517.40 g/mol, XLogP of 31.09, 47 rotatable bonds, 2 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-ethyl-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(furan-3-yl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(3-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(2-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-2-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-3-yl-N-(thiophen-2-ylmethyl)prop-2-enamide;(E)-N-ethyl-3-pyridin-4-yl-N-(thiophen-2-ylmethyl)prop-2-enamide is sourced from PubChem (CID 159795952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).