N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide

C32H28N6O2 — CID 67259642

IUPACN-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCc6ccccc6)ccn45)cccc32)n1
InChIInChI=1S/C32H28N6O2/c1-21-7-5-10-24(34-21)19-38-27-12-6-11-26(30(27)31(36-38)23-13-14-23)35-32(39)28-18-33-29-17-25(15-16-37(28)29)40-20-22-8-3-2-4-9-22/h2-12,15-18,23H,13-14,19-20H2,1H3,(H,35,39)
InChIKeyLQJAVRMAFKSBPD-UHFFFAOYSA-N
MW528.62 g/mol
LogP6.14
Rot. Bonds8

About N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide

N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 67259642) has the molecular formula C32H28N6O2 and a molecular weight of 528.62 g/mol. Its IUPAC name is N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID67259642
Molecular FormulaC32H28N6O2
Molecular Weight528.62 g/mol
Exact Mass528.23
IUPAC NameN-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCc6ccccc6)ccn45)cccc32)n1
InChIInChI=1S/C32H28N6O2/c1-21-7-5-10-24(34-21)19-38-27-12-6-11-26(30(27)31(36-38)23-13-14-23)35-32(39)28-18-33-29-17-25(15-16-37(28)29)40-20-22-8-3-2-4-9-22/h2-12,15-18,23H,13-14,19-20H2,1H3,(H,35,39)
InChIKeyLQJAVRMAFKSBPD-UHFFFAOYSA-N
XLogP6.14
TPSA86.34 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500528.62
LogP ≤ 56.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[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-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide (CID 67259642) is N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide is Cc1cccc(Cn2nc(C3CC3)c3c(NC(=O)c4cnc5cc(OCc6ccccc6)ccn45)cccc32)n1.
What is the InChIKey of N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is LQJAVRMAFKSBPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H28N6O2/c1-21-7-5-10-24(34-21)19-38-27-12-6-11-26(30(27)31(36-38)23-13-14-23)35-32(39)28-18-33-29-17-25(15-16-37(28)29)40-20-22-8-3-2-4-9-22/h2-12,15-18,23H,13-14,19-20H2,1H3,(H,35,39).
What are the key properties of N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide?
N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 528.62 g/mol, XLogP of 6.14, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-cyclopropyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-phenylmethoxyimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 67259642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).