4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide

C78H77Cl4F3N8O10 — CID 162237268

IUPAC4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide
SMILESCOCCn1cc(C(=O)NCc2ccc(C(C)(F)F)cc2)c2c(Cl)cccc21.COCCn1cc(C(=O)NCc2ccc3c(c2)OCC3)c2c(Cl)cccc21.COCCn1cc(C(=O)NCc2ccccc2F)c2c(Cl)cccc21.COCCn1cc(C(=O)NCc2ccco2)c2c(Cl)cccc21
InChIInChI=1S/C21H21ClF2N2O2.C21H21ClN2O3.C19H18ClFN2O2.C17H17ClN2O3/c1-21(23,24)15-8-6-14(7-9-15)12-25-20(27)16-13-26(10-11-28-2)18-5-3-4-17(22)19(16)18;1-26-10-8-24-13-16(20-17(22)3-2-4-18(20)24)21(25)23-12-14-5-6-15-7-9-27-19(15)11-14;1-25-10-9-23-12-14(18-15(20)6-4-8-17(18)23)19(24)22-11-13-5-2-3-7-16(13)21;1-22-9-7-20-11-13(16-14(18)5-2-6-15(16)20)17(21)19-10-12-4-3-8-23-12/h3-9,13H,10-12H2,1-2H3,(H,25,27);2-6,11,13H,7-10,12H2,1H3,(H,23,25);2-8,12H,9-11H2,1H3,(H,22,24);2-6,8,11H,7,9-10H2,1H3,(H,19,21)
InChIKeyZWFNQFJHGSDUOF-UHFFFAOYSA-N
MW1485.33 g/mol
LogP16.26
Rot. Bonds25

About 4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide

4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide (PubChem CID 162237268) has the molecular formula C78H77Cl4F3N8O10 and a molecular weight of 1485.33 g/mol. Its IUPAC name is 4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide
PubChem CID162237268
Molecular FormulaC78H77Cl4F3N8O10
Molecular Weight1485.33 g/mol
Exact Mass1482.45
IUPAC Name4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide
SMILESCOCCn1cc(C(=O)NCc2ccc(C(C)(F)F)cc2)c2c(Cl)cccc21.COCCn1cc(C(=O)NCc2ccc3c(c2)OCC3)c2c(Cl)cccc21.COCCn1cc(C(=O)NCc2ccccc2F)c2c(Cl)cccc21.COCCn1cc(C(=O)NCc2ccco2)c2c(Cl)cccc21
InChIInChI=1S/C21H21ClF2N2O2.C21H21ClN2O3.C19H18ClFN2O2.C17H17ClN2O3/c1-21(23,24)15-8-6-14(7-9-15)12-25-20(27)16-13-26(10-11-28-2)18-5-3-4-17(22)19(16)18;1-26-10-8-24-13-16(20-17(22)3-2-4-18(20)24)21(25)23-12-14-5-6-15-7-9-27-19(15)11-14;1-25-10-9-23-12-14(18-15(20)6-4-8-17(18)23)19(24)22-11-13-5-2-3-7-16(13)21;1-22-9-7-20-11-13(16-14(18)5-2-6-15(16)20)17(21)19-10-12-4-3-8-23-12/h3-9,13H,10-12H2,1-2H3,(H,25,27);2-6,11,13H,7-10,12H2,1H3,(H,23,25);2-8,12H,9-11H2,1H3,(H,22,24);2-6,8,11H,7,9-10H2,1H3,(H,19,21)
InChIKeyZWFNQFJHGSDUOF-UHFFFAOYSA-N
XLogP16.26
TPSA195.41 Ų
H-Bond Donors4
H-Bond Acceptors14
Rotatable Bonds25
Heavy Atoms103
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001485.33
LogP ≤ 516.26
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1014

Analyze 4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide?
The IUPAC name of 4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide (CID 162237268) is 4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide.
What is the SMILES notation for 4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide?
The canonical SMILES for 4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide is COCCn1cc(C(=O)NCc2ccc(C(C)(F)F)cc2)c2c(Cl)cccc21.COCCn1cc(C(=O)NCc2ccc3c(c2)OCC3)c2c(Cl)cccc21.COCCn1cc(C(=O)NCc2ccccc2F)c2c(Cl)cccc21.COCCn1cc(C(=O)NCc2ccco2)c2c(Cl)cccc21.
What is the InChIKey of 4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide?
The InChIKey is ZWFNQFJHGSDUOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21ClF2N2O2.C21H21ClN2O3.C19H18ClFN2O2.C17H17ClN2O3/c1-21(23,24)15-8-6-14(7-9-15)12-25-20(27)16-13-26(10-11-28-2)18-5-3-4-17(22)19(16)18;1-26-10-8-24-13-16(20-17(22)3-2-4-18(20)24)21(25)23-12-14-5-6-15-7-9-27-19(15)11-14;1-25-10-9-23-12-14(18-15(20)6-4-8-17(18)23)19(24)22-11-13-5-2-3-7-16(13)21;1-22-9-7-20-11-13(16-14(18)5-2-6-15(16)20)17(21)19-10-12-4-3-8-23-12/h3-9,13H,10-12H2,1-2H3,(H,25,27);2-6,11,13H,7-10,12H2,1H3,(H,23,25);2-8,12H,9-11H2,1H3,(H,22,24);2-6,8,11H,7,9-10H2,1H3,(H,19,21).
What are the key properties of 4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide?
4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide has a molecular weight of 1485.33 g/mol, XLogP of 16.26, 25 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(2,3-dihydro-1-benzofuran-6-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)indole-3-carboxamide;4-chloro-N-(furan-2-ylmethyl)-1-(2-methoxyethyl)indole-3-carboxamide is sourced from PubChem (CID 162237268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).