N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide

C89H79Cl6N21O6S5 — CID 161436621

IUPACN-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide
SMILESCc1ccsc1-c1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.Cc1sccc1-c1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.N#Cc1sccc1-c1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.O=C(Nc1cccc(Cl)c1)N1CCc2[nH]nc(-c3ccc(CO)s3)c2C1.O=C(Nc1cccc(Cl)c1)N1CCc2[nH]nc(-c3ccsc3Cl)c2C1
InChIInChI=1S/C18H14ClN5OS.C18H17ClN4O2S.2C18H17ClN4OS.C17H14Cl2N4OS/c19-11-2-1-3-12(8-11)21-18(25)24-6-4-15-14(10-24)17(23-22-15)13-5-7-26-16(13)9-20;19-11-2-1-3-12(8-11)20-18(25)23-7-6-15-14(9-23)17(22-21-15)16-5-4-13(10-24)26-16;1-11-14(6-8-25-11)17-15-10-23(7-5-16(15)21-22-17)18(24)20-13-4-2-3-12(19)9-13;1-11-6-8-25-17(11)16-14-10-23(7-5-15(14)21-22-16)18(24)20-13-4-2-3-12(19)9-13;18-10-2-1-3-11(8-10)20-17(24)23-6-4-14-13(9-23)15(22-21-14)12-5-7-25-16(12)19/h1-3,5,7-8H,4,6,10H2,(H,21,25)(H,22,23);1-5,8,24H,6-7,9-10H2,(H,20,25)(H,21,22);2*2-4,6,8-9H,5,7,10H2,1H3,(H,20,24)(H,21,22);1-3,5,7-8H,4,6,9H2,(H,20,24)(H,21,22)
InChIKeyVYSOMRZYFNDNKQ-UHFFFAOYSA-N
MW1911.80 g/mol
LogP22.54
Rot. Bonds11

About N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide

N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide (PubChem CID 161436621) has the molecular formula C89H79Cl6N21O6S5 and a molecular weight of 1911.80 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide
PubChem CID161436621
Molecular FormulaC89H79Cl6N21O6S5
Molecular Weight1911.80 g/mol
Exact Mass1907.33
IUPAC NameN-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide
SMILESCc1ccsc1-c1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.Cc1sccc1-c1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.N#Cc1sccc1-c1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.O=C(Nc1cccc(Cl)c1)N1CCc2[nH]nc(-c3ccc(CO)s3)c2C1.O=C(Nc1cccc(Cl)c1)N1CCc2[nH]nc(-c3ccsc3Cl)c2C1
InChIInChI=1S/C18H14ClN5OS.C18H17ClN4O2S.2C18H17ClN4OS.C17H14Cl2N4OS/c19-11-2-1-3-12(8-11)21-18(25)24-6-4-15-14(10-24)17(23-22-15)13-5-7-26-16(13)9-20;19-11-2-1-3-12(8-11)20-18(25)23-7-6-15-14(9-23)17(22-21-15)16-5-4-13(10-24)26-16;1-11-14(6-8-25-11)17-15-10-23(7-5-16(15)21-22-17)18(24)20-13-4-2-3-12(19)9-13;1-11-6-8-25-17(11)16-14-10-23(7-5-15(14)21-22-16)18(24)20-13-4-2-3-12(19)9-13;18-10-2-1-3-11(8-10)20-17(24)23-6-4-14-13(9-23)15(22-21-14)12-5-7-25-16(12)19/h1-3,5,7-8H,4,6,10H2,(H,21,25)(H,22,23);1-5,8,24H,6-7,9-10H2,(H,20,25)(H,21,22);2*2-4,6,8-9H,5,7,10H2,1H3,(H,20,24)(H,21,22);1-3,5,7-8H,4,6,9H2,(H,20,24)(H,21,22)
InChIKeyVYSOMRZYFNDNKQ-UHFFFAOYSA-N
XLogP22.54
TPSA349.12 Ų
H-Bond Donors11
H-Bond Acceptors17
Rotatable Bonds11
Heavy Atoms127
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001911.80
LogP ≤ 522.54
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1017

Analyze N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide (CID 161436621) is N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide is Cc1ccsc1-c1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.Cc1sccc1-c1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.N#Cc1sccc1-c1n[nH]c2c1CN(C(=O)Nc1cccc(Cl)c1)CC2.O=C(Nc1cccc(Cl)c1)N1CCc2[nH]nc(-c3ccc(CO)s3)c2C1.O=C(Nc1cccc(Cl)c1)N1CCc2[nH]nc(-c3ccsc3Cl)c2C1.
What is the InChIKey of N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?
The InChIKey is VYSOMRZYFNDNKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClN5OS.C18H17ClN4O2S.2C18H17ClN4OS.C17H14Cl2N4OS/c19-11-2-1-3-12(8-11)21-18(25)24-6-4-15-14(10-24)17(23-22-15)13-5-7-26-16(13)9-20;19-11-2-1-3-12(8-11)20-18(25)23-7-6-15-14(9-23)17(22-21-15)16-5-4-13(10-24)26-16;1-11-14(6-8-25-11)17-15-10-23(7-5-16(15)21-22-17)18(24)20-13-4-2-3-12(19)9-13;1-11-6-8-25-17(11)16-14-10-23(7-5-15(14)21-22-16)18(24)20-13-4-2-3-12(19)9-13;18-10-2-1-3-11(8-10)20-17(24)23-6-4-14-13(9-23)15(22-21-14)12-5-7-25-16(12)19/h1-3,5,7-8H,4,6,10H2,(H,21,25)(H,22,23);1-5,8,24H,6-7,9-10H2,(H,20,25)(H,21,22);2*2-4,6,8-9H,5,7,10H2,1H3,(H,20,24)(H,21,22);1-3,5,7-8H,4,6,9H2,(H,20,24)(H,21,22).
What are the key properties of N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?
N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide has a molecular weight of 1911.80 g/mol, XLogP of 22.54, 11 rotatable bonds, 11 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-3-(2-chlorothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-cyanothiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-[5-(hydroxymethyl)thiophen-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(2-methylthiophen-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(3-methylthiophen-2-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide is sourced from PubChem (CID 161436621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).