5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide

C108H93Cl2F10N17O10 — CID 161042123

IUPAC5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide
SMILESCC(NC(=O)c1cc2cc(OC(F)(F)F)ccc2[nH]1)c1cnn(C)c1.C[C@@H](NC(=O)c1cc2cc(OC(F)(F)F)ccc2[nH]1)c1ccccc1.Cn1cc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CCCC2)cn1.N#Cc1ccc2[nH]c(C(=O)NC3(c4ccc(F)cc4)COC3)cc2c1.O=C(NC1(c2ccccc2)CC1)c1cc2cc(Cl)ccc2[nH]1.O=C(NC1(c2ccccc2)CC1)c1cc2cc(OC(F)(F)F)ccc2[nH]1
InChIInChI=1S/C19H15F3N2O2.C19H14FN3O2.C18H19ClN4O.C18H15ClN2O.C18H15F3N2O2.C16H15F3N4O2/c20-19(21,22)26-14-6-7-15-12(10-14)11-16(23-15)17(25)24-18(8-9-18)13-4-2-1-3-5-13;20-15-4-2-14(3-5-15)19(10-25-11-19)23-18(24)17-8-13-7-12(9-21)1-6-16(13)22-17;1-23-11-13(10-20-23)18(6-2-3-7-18)22-17(24)16-9-12-8-14(19)4-5-15(12)21-16;19-14-6-7-15-12(10-14)11-16(20-15)17(22)21-18(8-9-18)13-4-2-1-3-5-13;1-11(12-5-3-2-4-6-12)22-17(24)16-10-13-9-14(25-18(19,20)21)7-8-15(13)23-16;1-9(11-7-20-23(2)8-11)21-15(24)14-6-10-5-12(25-16(17,18)19)3-4-13(10)22-14/h1-7,10-11,23H,8-9H2,(H,24,25);1-8,22H,10-11H2,(H,23,24);4-5,8-11,21H,2-3,6-7H2,1H3,(H,22,24);1-7,10-11,20H,8-9H2,(H,21,22);2-11,23H,1H3,(H,22,24);3-9,22H,1-2H3,(H,21,24)/t;;;;11-;/m....1./s1
InChIKeyUBABKFGBFUXBOJ-ULQZELJQSA-N
MW2049.93 g/mol
LogP23.16
Rot. Bonds21

About 5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide

5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide (PubChem CID 161042123) has the molecular formula C108H93Cl2F10N17O10 and a molecular weight of 2049.93 g/mol. Its IUPAC name is 5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide
PubChem CID161042123
Molecular FormulaC108H93Cl2F10N17O10
Molecular Weight2049.93 g/mol
Exact Mass2047.65
IUPAC Name5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide
SMILESCC(NC(=O)c1cc2cc(OC(F)(F)F)ccc2[nH]1)c1cnn(C)c1.C[C@@H](NC(=O)c1cc2cc(OC(F)(F)F)ccc2[nH]1)c1ccccc1.Cn1cc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CCCC2)cn1.N#Cc1ccc2[nH]c(C(=O)NC3(c4ccc(F)cc4)COC3)cc2c1.O=C(NC1(c2ccccc2)CC1)c1cc2cc(Cl)ccc2[nH]1.O=C(NC1(c2ccccc2)CC1)c1cc2cc(OC(F)(F)F)ccc2[nH]1
InChIInChI=1S/C19H15F3N2O2.C19H14FN3O2.C18H19ClN4O.C18H15ClN2O.C18H15F3N2O2.C16H15F3N4O2/c20-19(21,22)26-14-6-7-15-12(10-14)11-16(23-15)17(25)24-18(8-9-18)13-4-2-1-3-5-13;20-15-4-2-14(3-5-15)19(10-25-11-19)23-18(24)17-8-13-7-12(9-21)1-6-16(13)22-17;1-23-11-13(10-20-23)18(6-2-3-7-18)22-17(24)16-9-12-8-14(19)4-5-15(12)21-16;19-14-6-7-15-12(10-14)11-16(20-15)17(22)21-18(8-9-18)13-4-2-1-3-5-13;1-11(12-5-3-2-4-6-12)22-17(24)16-10-13-9-14(25-18(19,20)21)7-8-15(13)23-16;1-9(11-7-20-23(2)8-11)21-15(24)14-6-10-5-12(25-16(17,18)19)3-4-13(10)22-14/h1-7,10-11,23H,8-9H2,(H,24,25);1-8,22H,10-11H2,(H,23,24);4-5,8-11,21H,2-3,6-7H2,1H3,(H,22,24);1-7,10-11,20H,8-9H2,(H,21,22);2-11,23H,1H3,(H,22,24);3-9,22H,1-2H3,(H,21,24)/t;;;;11-;/m....1./s1
InChIKeyUBABKFGBFUXBOJ-ULQZELJQSA-N
XLogP23.16
TPSA365.69 Ų
H-Bond Donors12
H-Bond Acceptors15
Rotatable Bonds21
Heavy Atoms147
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002049.93
LogP ≤ 523.16
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1015

Analyze 5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide?
The IUPAC name of 5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide (CID 161042123) is 5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide?
The canonical SMILES for 5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide is CC(NC(=O)c1cc2cc(OC(F)(F)F)ccc2[nH]1)c1cnn(C)c1.C[C@@H](NC(=O)c1cc2cc(OC(F)(F)F)ccc2[nH]1)c1ccccc1.Cn1cc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CCCC2)cn1.N#Cc1ccc2[nH]c(C(=O)NC3(c4ccc(F)cc4)COC3)cc2c1.O=C(NC1(c2ccccc2)CC1)c1cc2cc(Cl)ccc2[nH]1.O=C(NC1(c2ccccc2)CC1)c1cc2cc(OC(F)(F)F)ccc2[nH]1.
What is the InChIKey of 5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide?
The InChIKey is UBABKFGBFUXBOJ-ULQZELJQSA-N. The full InChI is InChI=1S/C19H15F3N2O2.C19H14FN3O2.C18H19ClN4O.C18H15ClN2O.C18H15F3N2O2.C16H15F3N4O2/c20-19(21,22)26-14-6-7-15-12(10-14)11-16(23-15)17(25)24-18(8-9-18)13-4-2-1-3-5-13;20-15-4-2-14(3-5-15)19(10-25-11-19)23-18(24)17-8-13-7-12(9-21)1-6-16(13)22-17;1-23-11-13(10-20-23)18(6-2-3-7-18)22-17(24)16-9-12-8-14(19)4-5-15(12)21-16;19-14-6-7-15-12(10-14)11-16(20-15)17(22)21-18(8-9-18)13-4-2-1-3-5-13;1-11(12-5-3-2-4-6-12)22-17(24)16-10-13-9-14(25-18(19,20)21)7-8-15(13)23-16;1-9(11-7-20-23(2)8-11)21-15(24)14-6-10-5-12(25-16(17,18)19)3-4-13(10)22-14/h1-7,10-11,23H,8-9H2,(H,24,25);1-8,22H,10-11H2,(H,23,24);4-5,8-11,21H,2-3,6-7H2,1H3,(H,22,24);1-7,10-11,20H,8-9H2,(H,21,22);2-11,23H,1H3,(H,22,24);3-9,22H,1-2H3,(H,21,24)/t;;;;11-;/m....1./s1.
What are the key properties of 5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide?
5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide has a molecular weight of 2049.93 g/mol, XLogP of 23.16, 21 rotatable bonds, 12 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopentyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-cyano-N-[3-(4-fluorophenyl)oxetan-3-yl]-1H-indole-2-carboxamide;N-[1-(1-methylpyrazol-4-yl)ethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-(1-phenylcyclopropyl)-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide is sourced from PubChem (CID 161042123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).