N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide

C21H25N7O — CID 151066777

IUPACN-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide
SMILESCc1cc(NC(=O)c2cnc(NCCN3CCNCC3)cn2)c2ncccc2c1
InChIInChI=1S/C21H25N7O/c1-15-11-16-3-2-4-24-20(16)17(12-15)27-21(29)18-13-26-19(14-25-18)23-7-10-28-8-5-22-6-9-28/h2-4,11-14,22H,5-10H2,1H3,(H,23,26)(H,27,29)
InChIKeyMHHGUHPYKBFFQM-UHFFFAOYSA-N
MW391.48 g/mol
LogP1.90
Rot. Bonds6

About N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide

N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide (PubChem CID 151066777) has the molecular formula C21H25N7O and a molecular weight of 391.48 g/mol. Its IUPAC name is N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide
PubChem CID151066777
Molecular FormulaC21H25N7O
Molecular Weight391.48 g/mol
Exact Mass391.21
IUPAC NameN-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide
SMILESCc1cc(NC(=O)c2cnc(NCCN3CCNCC3)cn2)c2ncccc2c1
InChIInChI=1S/C21H25N7O/c1-15-11-16-3-2-4-24-20(16)17(12-15)27-21(29)18-13-26-19(14-25-18)23-7-10-28-8-5-22-6-9-28/h2-4,11-14,22H,5-10H2,1H3,(H,23,26)(H,27,29)
InChIKeyMHHGUHPYKBFFQM-UHFFFAOYSA-N
XLogP1.90
TPSA95.07 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.48
LogP ≤ 51.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

5-methyl-N-(6-methylquinolin-8-yl)pyrazine-2-carboxamide
CID 147349053
5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxylic acid
CID 107372352
5-(2-methylpropylamino)-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109273088
N-(6-piperazin-1-ylquinolin-8-yl)pyridine-2-carboxamide
CID 24876411
N-(6-methylquinolin-8-yl)-6-oxo-1H-pyridazine-3-carboxamide
CID 110742590
5-[(2-methylphenyl)methylamino]-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109280202
5-(3-chloro-4-methylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109293181
6-methyl-2-(2-morpholin-4-ylethylamino)-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109325286
5-(2,6-dimethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109291330
N-[3-[2-(4-methylpiperazin-1-yl)ethyl]phenyl]-N'-(6-methylquinolin-8-yl)oxamide
CID 167795587
N-(3-methoxyphenyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide
CID 109277688
2,6-dimethoxy-N-(6-methylquinolin-8-yl)benzamide
CID 110715570

Frequently Asked Questions

What is the IUPAC name of N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide (CID 151066777) is N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide is Cc1cc(NC(=O)c2cnc(NCCN3CCNCC3)cn2)c2ncccc2c1.
What is the InChIKey of N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide?
The InChIKey is MHHGUHPYKBFFQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N7O/c1-15-11-16-3-2-4-24-20(16)17(12-15)27-21(29)18-13-26-19(14-25-18)23-7-10-28-8-5-22-6-9-28/h2-4,11-14,22H,5-10H2,1H3,(H,23,26)(H,27,29).
What are the key properties of N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide?
N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide has a molecular weight of 391.48 g/mol, XLogP of 1.90, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methylquinolin-8-yl)-5-(2-piperazin-1-ylethylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 151066777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).