N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide

C79H82N26O6 — CID 159087293

IUPACN,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide
SMILESCCC(=O)Cc1ccc(-c2cnc3n[nH]c(-c4nc5c(C(=O)N(CC)CC)cncc5[nH]4)c3c2)cn1.CCN(CC)C(=O)c1cncc2[nH]c(-c3[nH]nc4ncc(-c5cncc(NC(=O)C(C)C)c5)cc34)nc12.CCN(CC)C(=O)c1cncc2[nH]c(-c3[nH]nc4ncc(-c5cncc(NC(=O)CC(C)C)c5)cc34)nc12
InChIInChI=1S/C27H29N9O2.C26H27N9O2.C26H26N8O2/c1-5-36(6-2)27(38)20-13-29-14-21-23(20)33-26(32-21)24-19-9-17(11-30-25(19)35-34-24)16-8-18(12-28-10-16)31-22(37)7-15(3)4;1-5-35(6-2)26(37)19-12-28-13-20-21(19)32-24(31-20)22-18-8-16(10-29-23(18)34-33-22)15-7-17(11-27-9-15)30-25(36)14(3)4;1-4-18(35)10-17-8-7-15(11-28-17)16-9-19-23(32-33-24(19)29-12-16)25-30-21-14-27-13-20(22(21)31-25)26(36)34(5-2)6-3/h8-15H,5-7H2,1-4H3,(H,31,37)(H,32,33)(H,30,34,35);7-14H,5-6H2,1-4H3,(H,30,36)(H,31,32)(H,29,33,34);7-9,11-14H,4-6,10H2,1-3H3,(H,30,31)(H,29,32,33)
InChIKeyKBPHZGGWQBGNOH-UHFFFAOYSA-N
MW1491.70 g/mol
LogP12.42
Rot. Bonds23

About N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide

N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide (PubChem CID 159087293) has the molecular formula C79H82N26O6 and a molecular weight of 1491.70 g/mol. Its IUPAC name is N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide
PubChem CID159087293
Molecular FormulaC79H82N26O6
Molecular Weight1491.70 g/mol
Exact Mass1490.69
IUPAC NameN,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide
SMILESCCC(=O)Cc1ccc(-c2cnc3n[nH]c(-c4nc5c(C(=O)N(CC)CC)cncc5[nH]4)c3c2)cn1.CCN(CC)C(=O)c1cncc2[nH]c(-c3[nH]nc4ncc(-c5cncc(NC(=O)C(C)C)c5)cc34)nc12.CCN(CC)C(=O)c1cncc2[nH]c(-c3[nH]nc4ncc(-c5cncc(NC(=O)CC(C)C)c5)cc34)nc12
InChIInChI=1S/C27H29N9O2.C26H27N9O2.C26H26N8O2/c1-5-36(6-2)27(38)20-13-29-14-21-23(20)33-26(32-21)24-19-9-17(11-30-25(19)35-34-24)16-8-18(12-28-10-16)31-22(37)7-15(3)4;1-5-35(6-2)26(37)19-12-28-13-20-21(19)32-24(31-20)22-18-8-16(10-29-23(18)34-33-22)15-7-17(11-27-9-15)30-25(36)14(3)4;1-4-18(35)10-17-8-7-15(11-28-17)16-9-19-23(32-33-24(19)29-12-16)25-30-21-14-27-13-20(22(21)31-25)26(36)34(5-2)6-3/h8-15H,5-7H2,1-4H3,(H,31,37)(H,32,33)(H,30,34,35);7-14H,5-6H2,1-4H3,(H,30,36)(H,31,32)(H,29,33,34);7-9,11-14H,4-6,10H2,1-3H3,(H,30,31)(H,29,32,33)
InChIKeyKBPHZGGWQBGNOH-UHFFFAOYSA-N
XLogP12.42
TPSA424.29 Ų
H-Bond Donors8
H-Bond Acceptors21
Rotatable Bonds23
Heavy Atoms111
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001491.70
LogP ≤ 512.42
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1021

Analyze N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide?
The IUPAC name of N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide (CID 159087293) is N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide.
What is the SMILES notation for N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide?
The canonical SMILES for N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide is CCC(=O)Cc1ccc(-c2cnc3n[nH]c(-c4nc5c(C(=O)N(CC)CC)cncc5[nH]4)c3c2)cn1.CCN(CC)C(=O)c1cncc2[nH]c(-c3[nH]nc4ncc(-c5cncc(NC(=O)C(C)C)c5)cc34)nc12.CCN(CC)C(=O)c1cncc2[nH]c(-c3[nH]nc4ncc(-c5cncc(NC(=O)CC(C)C)c5)cc34)nc12.
What is the InChIKey of N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide?
The InChIKey is KBPHZGGWQBGNOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29N9O2.C26H27N9O2.C26H26N8O2/c1-5-36(6-2)27(38)20-13-29-14-21-23(20)33-26(32-21)24-19-9-17(11-30-25(19)35-34-24)16-8-18(12-28-10-16)31-22(37)7-15(3)4;1-5-35(6-2)26(37)19-12-28-13-20-21(19)32-24(31-20)22-18-8-16(10-29-23(18)34-33-22)15-7-17(11-27-9-15)30-25(36)14(3)4;1-4-18(35)10-17-8-7-15(11-28-17)16-9-19-23(32-33-24(19)29-12-16)25-30-21-14-27-13-20(22(21)31-25)26(36)34(5-2)6-3/h8-15H,5-7H2,1-4H3,(H,31,37)(H,32,33)(H,30,34,35);7-14H,5-6H2,1-4H3,(H,30,36)(H,31,32)(H,29,33,34);7-9,11-14H,4-6,10H2,1-3H3,(H,30,31)(H,29,32,33).
What are the key properties of N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide?
N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide has a molecular weight of 1491.70 g/mol, XLogP of 12.42, 23 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[5-[5-(3-methylbutanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N,N-diethyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide is sourced from PubChem (CID 159087293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).