N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine

C26H26ClN7 — CID 171355654

IUPACN-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine
SMILESCc1[nH]nc2ccc(-c3nc4cnc(N5CCC(C)CC5)cn4c3Nc3ccc(Cl)cc3)cc12
InChIInChI=1S/C26H26ClN7/c1-16-9-11-33(12-10-16)24-15-34-23(14-28-24)30-25(26(34)29-20-6-4-19(27)5-7-20)18-3-8-22-21(13-18)17(2)31-32-22/h3-8,13-16,29H,9-12H2,1-2H3,(H,31,32)
InChIKeyRLBKGJRQHCBHLN-UHFFFAOYSA-N
MW472.00 g/mol
LogP6.21
Rot. Bonds4

About N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine

N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine (PubChem CID 171355654) has the molecular formula C26H26ClN7 and a molecular weight of 472.00 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine
PubChem CID171355654
Molecular FormulaC26H26ClN7
Molecular Weight472.00 g/mol
Exact Mass471.19
IUPAC NameN-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine
SMILESCc1[nH]nc2ccc(-c3nc4cnc(N5CCC(C)CC5)cn4c3Nc3ccc(Cl)cc3)cc12
InChIInChI=1S/C26H26ClN7/c1-16-9-11-33(12-10-16)24-15-34-23(14-28-24)30-25(26(34)29-20-6-4-19(27)5-7-20)18-3-8-22-21(13-18)17(2)31-32-22/h3-8,13-16,29H,9-12H2,1-2H3,(H,31,32)
InChIKeyRLBKGJRQHCBHLN-UHFFFAOYSA-N
XLogP6.21
TPSA74.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500472.00
LogP ≤ 56.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine 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-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine?
The IUPAC name of N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine (CID 171355654) is N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine.
What is the SMILES notation for N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine?
The canonical SMILES for N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine is Cc1[nH]nc2ccc(-c3nc4cnc(N5CCC(C)CC5)cn4c3Nc3ccc(Cl)cc3)cc12.
What is the InChIKey of N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine?
The InChIKey is RLBKGJRQHCBHLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26ClN7/c1-16-9-11-33(12-10-16)24-15-34-23(14-28-24)30-25(26(34)29-20-6-4-19(27)5-7-20)18-3-8-22-21(13-18)17(2)31-32-22/h3-8,13-16,29H,9-12H2,1-2H3,(H,31,32).
What are the key properties of N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine?
N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine has a molecular weight of 472.00 g/mol, XLogP of 6.21, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-(3-methyl-2H-indazol-5-yl)-6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyrazin-3-amine is sourced from PubChem (CID 171355654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).