2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide

C90H71N13O8S4 — CID 158417139

IUPAC2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide
SMILESCOc1cccc(C(=O)NCc2cc3c(-c4ccc5ccccc5c4)[nH]nc3s2)c1.COc1ccccc1C(=O)NCc1cc2c(-c3ccc4ccccc4c3)[nH]nc2s1.O=C(NCc1cc2c(-c3ccc4ccccc4c3)[nH]nc2s1)c1ccco1.O=C1CC[C@@H](C(=O)NCc2cc3c(-c4ccc5ccccc5c4)[nH]nc3s2)N1
InChIInChI=1S/2C24H19N3O2S.C21H18N4O2S.C21H15N3O2S/c1-29-21-9-5-4-8-19(21)23(28)25-14-18-13-20-22(26-27-24(20)30-18)17-11-10-15-6-2-3-7-16(15)12-17;1-29-19-8-4-7-18(12-19)23(28)25-14-20-13-21-22(26-27-24(21)30-20)17-10-9-15-5-2-3-6-16(15)11-17;26-18-8-7-17(23-18)20(27)22-11-15-10-16-19(24-25-21(16)28-15)14-6-5-12-3-1-2-4-13(12)9-14;25-20(18-6-3-9-26-18)22-12-16-11-17-19(23-24-21(17)27-16)15-8-7-13-4-1-2-5-14(13)10-15/h2*2-13H,14H2,1H3,(H,25,28)(H,26,27);1-6,9-10,17H,7-8,11H2,(H,22,27)(H,23,26)(H,24,25);1-11H,12H2,(H,22,25)(H,23,24)/t;;17-;/m..0./s1
InChIKeyHAANVJZEMXLXGL-CDWTUIBGSA-N
MW1590.91 g/mol
LogP19.07
Rot. Bonds18

About 2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide

2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide (PubChem CID 158417139) has the molecular formula C90H71N13O8S4 and a molecular weight of 1590.91 g/mol. Its IUPAC name is 2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide
PubChem CID158417139
Molecular FormulaC90H71N13O8S4
Molecular Weight1590.91 g/mol
Exact Mass1589.44
IUPAC Name2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide
SMILESCOc1cccc(C(=O)NCc2cc3c(-c4ccc5ccccc5c4)[nH]nc3s2)c1.COc1ccccc1C(=O)NCc1cc2c(-c3ccc4ccccc4c3)[nH]nc2s1.O=C(NCc1cc2c(-c3ccc4ccccc4c3)[nH]nc2s1)c1ccco1.O=C1CC[C@@H](C(=O)NCc2cc3c(-c4ccc5ccccc5c4)[nH]nc3s2)N1
InChIInChI=1S/2C24H19N3O2S.C21H18N4O2S.C21H15N3O2S/c1-29-21-9-5-4-8-19(21)23(28)25-14-18-13-20-22(26-27-24(20)30-18)17-11-10-15-6-2-3-7-16(15)12-17;1-29-19-8-4-7-18(12-19)23(28)25-14-20-13-21-22(26-27-24(21)30-20)17-10-9-15-5-2-3-6-16(15)11-17;26-18-8-7-17(23-18)20(27)22-11-15-10-16-19(24-25-21(16)28-15)14-6-5-12-3-1-2-4-13(12)9-14;25-20(18-6-3-9-26-18)22-12-16-11-17-19(23-24-21(17)27-16)15-8-7-13-4-1-2-5-14(13)10-15/h2*2-13H,14H2,1H3,(H,25,28)(H,26,27);1-6,9-10,17H,7-8,11H2,(H,22,27)(H,23,26)(H,24,25);1-11H,12H2,(H,22,25)(H,23,24)/t;;17-;/m..0./s1
InChIKeyHAANVJZEMXLXGL-CDWTUIBGSA-N
XLogP19.07
TPSA291.82 Ų
H-Bond Donors9
H-Bond Acceptors16
Rotatable Bonds18
Heavy Atoms115
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001590.91
LogP ≤ 519.07
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1016

Analyze 2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of 2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide (CID 158417139) is 2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for 2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for 2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide is COc1cccc(C(=O)NCc2cc3c(-c4ccc5ccccc5c4)[nH]nc3s2)c1.COc1ccccc1C(=O)NCc1cc2c(-c3ccc4ccccc4c3)[nH]nc2s1.O=C(NCc1cc2c(-c3ccc4ccccc4c3)[nH]nc2s1)c1ccco1.O=C1CC[C@@H](C(=O)NCc2cc3c(-c4ccc5ccccc5c4)[nH]nc3s2)N1.
What is the InChIKey of 2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide?
The InChIKey is HAANVJZEMXLXGL-CDWTUIBGSA-N. The full InChI is InChI=1S/2C24H19N3O2S.C21H18N4O2S.C21H15N3O2S/c1-29-21-9-5-4-8-19(21)23(28)25-14-18-13-20-22(26-27-24(20)30-18)17-11-10-15-6-2-3-7-16(15)12-17;1-29-19-8-4-7-18(12-19)23(28)25-14-20-13-21-22(26-27-24(21)30-20)17-10-9-15-5-2-3-6-16(15)11-17;26-18-8-7-17(23-18)20(27)22-11-15-10-16-19(24-25-21(16)28-15)14-6-5-12-3-1-2-4-13(12)9-14;25-20(18-6-3-9-26-18)22-12-16-11-17-19(23-24-21(17)27-16)15-8-7-13-4-1-2-5-14(13)10-15/h2*2-13H,14H2,1H3,(H,25,28)(H,26,27);1-6,9-10,17H,7-8,11H2,(H,22,27)(H,23,26)(H,24,25);1-11H,12H2,(H,22,25)(H,23,24)/t;;17-;/m..0./s1.
What are the key properties of 2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide?
2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide has a molecular weight of 1590.91 g/mol, XLogP of 19.07, 18 rotatable bonds, 9 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;3-methoxy-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]benzamide;N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]furan-2-carboxamide;(2S)-N-[(3-naphthalen-2-yl-2H-thieno[2,3-c]pyrazol-5-yl)methyl]-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 158417139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).