N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide

C32H37N7O2 — CID 90146501

IUPACN-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCC5CCN(C)CC5)ccn34)c12
InChIInChI=1S/C32H37N7O2/c1-4-26-31-27(9-6-10-28(31)39(36-26)21-24-8-5-7-22(2)34-24)35-32(40)29-20-33-30-19-25(13-17-38(29)30)41-18-14-23-11-15-37(3)16-12-23/h5-10,13,17,19-20,23H,4,11-12,14-16,18,21H2,1-3H3,(H,35,40)
InChIKeyRLHYTZNLHADRSA-UHFFFAOYSA-N
MW551.70 g/mol
LogP5.36
Rot. Bonds9

About N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide

N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 90146501) has the molecular formula C32H37N7O2 and a molecular weight of 551.70 g/mol. Its IUPAC name is N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID90146501
Molecular FormulaC32H37N7O2
Molecular Weight551.70 g/mol
Exact Mass551.30
IUPAC NameN-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCC5CCN(C)CC5)ccn34)c12
InChIInChI=1S/C32H37N7O2/c1-4-26-31-27(9-6-10-28(31)39(36-26)21-24-8-5-7-22(2)34-24)35-32(40)29-20-33-30-19-25(13-17-38(29)30)41-18-14-23-11-15-37(3)16-12-23/h5-10,13,17,19-20,23H,4,11-12,14-16,18,21H2,1-3H3,(H,35,40)
InChIKeyRLHYTZNLHADRSA-UHFFFAOYSA-N
XLogP5.36
TPSA89.58 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500551.70
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide (CID 90146501) is N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide is CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(OCCC5CCN(C)CC5)ccn34)c12.
What is the InChIKey of N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is RLHYTZNLHADRSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H37N7O2/c1-4-26-31-27(9-6-10-28(31)39(36-26)21-24-8-5-7-22(2)34-24)35-32(40)29-20-33-30-19-25(13-17-38(29)30)41-18-14-23-11-15-37(3)16-12-23/h5-10,13,17,19-20,23H,4,11-12,14-16,18,21H2,1-3H3,(H,35,40).
What are the key properties of N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide?
N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 551.70 g/mol, XLogP of 5.36, 9 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-[2-(1-methylpiperidin-4-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 90146501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).