5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide)

C88H80Cl2N18O7 — CID 157483877

IUPAC5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide)
SMILESCc1cc(C(C)NC(=O)c2cc3cc(C#N)ccc3[nH]2)no1.Cc1cc(C(C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)no1.Cc1nc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)n[nH]1.N#Cc1ccc2[nH]c(C(=O)NC3(c4ccccc4)CCCC3)cc2c1.N#Cc1ccc2[nH]c(C(=O)NC3(c4ccccc4)CCCC3)cc2c1
InChIInChI=1S/2C21H19N3O.C16H14N4O2.C15H14ClN5O.C15H14ClN3O2/c2*22-14-15-8-9-18-16(12-15)13-19(23-18)20(25)24-21(10-4-5-11-21)17-6-2-1-3-7-17;1-9-5-14(20-22-9)10(2)18-16(21)15-7-12-6-11(8-17)3-4-13(12)19-15;1-8-17-14(21-20-8)15(4-5-15)19-13(22)12-7-9-6-10(16)2-3-11(9)18-12;1-8-5-13(19-21-8)9(2)17-15(20)14-7-10-6-11(16)3-4-12(10)18-14/h2*1-3,6-9,12-13,23H,4-5,10-11H2,(H,24,25);3-7,10,19H,1-2H3,(H,18,21);2-3,6-7,18H,4-5H2,1H3,(H,19,22)(H,17,20,21);3-7,9,18H,1-2H3,(H,17,20)
InChIKeyBWMBNBJOBONGCN-UHFFFAOYSA-N
MW1572.63 g/mol
LogP17.58
Rot. Bonds15

About 5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide)

5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide) (PubChem CID 157483877) has the molecular formula C88H80Cl2N18O7 and a molecular weight of 1572.63 g/mol. Its IUPAC name is 5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide).

Molecular Properties

Compound Name5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide)
PubChem CID157483877
Molecular FormulaC88H80Cl2N18O7
Molecular Weight1572.63 g/mol
Exact Mass1570.58
IUPAC Name5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide)
SMILESCc1cc(C(C)NC(=O)c2cc3cc(C#N)ccc3[nH]2)no1.Cc1cc(C(C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)no1.Cc1nc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)n[nH]1.N#Cc1ccc2[nH]c(C(=O)NC3(c4ccccc4)CCCC3)cc2c1.N#Cc1ccc2[nH]c(C(=O)NC3(c4ccccc4)CCCC3)cc2c1
InChIInChI=1S/2C21H19N3O.C16H14N4O2.C15H14ClN5O.C15H14ClN3O2/c2*22-14-15-8-9-18-16(12-15)13-19(23-18)20(25)24-21(10-4-5-11-21)17-6-2-1-3-7-17;1-9-5-14(20-22-9)10(2)18-16(21)15-7-12-6-11(8-17)3-4-13(12)19-15;1-8-17-14(21-20-8)15(4-5-15)19-13(22)12-7-9-6-10(16)2-3-11(9)18-12;1-8-5-13(19-21-8)9(2)17-15(20)14-7-10-6-11(16)3-4-12(10)18-14/h2*1-3,6-9,12-13,23H,4-5,10-11H2,(H,24,25);3-7,10,19H,1-2H3,(H,18,21);2-3,6-7,18H,4-5H2,1H3,(H,19,22)(H,17,20,21);3-7,9,18H,1-2H3,(H,17,20)
InChIKeyBWMBNBJOBONGCN-UHFFFAOYSA-N
XLogP17.58
TPSA389.45 Ų
H-Bond Donors11
H-Bond Acceptors14
Rotatable Bonds15
Heavy Atoms115
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001572.63
LogP ≤ 517.58
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1014

Analyze 5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide) with MolForge

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Related Compounds

5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide;5-cyano-N-[1-(2-methyl-1,3-oxazol-5-yl)ethyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide)
CID 159446582
5-chloro-4-fluoro-N-(3-phenyloxetan-3-yl)-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;6-(difluoromethyl)-N-(3-phenyloxetan-3-yl)-1H-indole-2-carboxamide
CID 159726875
5-chloro-4-fluoro-N-(3-phenyloxetan-3-yl)-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;6-(difluoromethyl)-N-(3-phenyloxetan-3-yl)-1H-indole-2-carboxamide
CID 160800457
5-chloro-7-fluoro-N-(3-phenyloxetan-3-yl)-1H-indole-2-carboxamide;5-chloro-N-[1-(2-methyl-1,3-oxazol-5-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide;5-cyano-N-[1-(2-methyl-1,3-oxazol-5-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide)
CID 161025854

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide)?
The IUPAC name of 5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide) (CID 157483877) is 5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide).
What is the SMILES notation for 5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide)?
The canonical SMILES for 5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide) is Cc1cc(C(C)NC(=O)c2cc3cc(C#N)ccc3[nH]2)no1.Cc1cc(C(C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)no1.Cc1nc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)n[nH]1.N#Cc1ccc2[nH]c(C(=O)NC3(c4ccccc4)CCCC3)cc2c1.N#Cc1ccc2[nH]c(C(=O)NC3(c4ccccc4)CCCC3)cc2c1.
What is the InChIKey of 5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide)?
The InChIKey is BWMBNBJOBONGCN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C21H19N3O.C16H14N4O2.C15H14ClN5O.C15H14ClN3O2/c2*22-14-15-8-9-18-16(12-15)13-19(23-18)20(25)24-21(10-4-5-11-21)17-6-2-1-3-7-17;1-9-5-14(20-22-9)10(2)18-16(21)15-7-12-6-11(8-17)3-4-13(12)19-15;1-8-17-14(21-20-8)15(4-5-15)19-13(22)12-7-9-6-10(16)2-3-11(9)18-12;1-8-5-13(19-21-8)9(2)17-15(20)14-7-10-6-11(16)3-4-12(10)18-14/h2*1-3,6-9,12-13,23H,4-5,10-11H2,(H,24,25);3-7,10,19H,1-2H3,(H,18,21);2-3,6-7,18H,4-5H2,1H3,(H,19,22)(H,17,20,21);3-7,9,18H,1-2H3,(H,17,20).
What are the key properties of 5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide)?
5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide) has a molecular weight of 1572.63 g/mol, XLogP of 17.58, 15 rotatable bonds, 11 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[1-(5-methyl-1,2-oxazol-3-yl)ethyl]-1H-indole-2-carboxamide;bis(5-cyano-N-(1-phenylcyclopentyl)-1H-indole-2-carboxamide) is sourced from PubChem (CID 157483877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).