2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide

C21H26N6O — CID 166228678

IUPAC2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide
SMILESCc1cn2ccnc(C(=O)Nc3ccc(N(C)C4CCN(C)CC4)cc3)c2n1
InChIInChI=1S/C21H26N6O/c1-15-14-27-13-10-22-19(20(27)23-15)21(28)24-16-4-6-17(7-5-16)26(3)18-8-11-25(2)12-9-18/h4-7,10,13-14,18H,8-9,11-12H2,1-3H3,(H,24,28)
InChIKeyAOVBQQJWBBUBEN-UHFFFAOYSA-N
MW378.48 g/mol
LogP2.82
Rot. Bonds4

About 2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide

2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide (PubChem CID 166228678) has the molecular formula C21H26N6O and a molecular weight of 378.48 g/mol. Its IUPAC name is 2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide
PubChem CID166228678
Molecular FormulaC21H26N6O
Molecular Weight378.48 g/mol
Exact Mass378.22
IUPAC Name2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide
SMILESCc1cn2ccnc(C(=O)Nc3ccc(N(C)C4CCN(C)CC4)cc3)c2n1
InChIInChI=1S/C21H26N6O/c1-15-14-27-13-10-22-19(20(27)23-15)21(28)24-16-4-6-17(7-5-16)26(3)18-8-11-25(2)12-9-18/h4-7,10,13-14,18H,8-9,11-12H2,1-3H3,(H,24,28)
InChIKeyAOVBQQJWBBUBEN-UHFFFAOYSA-N
XLogP2.82
TPSA65.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.48
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide with MolForge

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Related Compounds

N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-[methyl-(1-methylpiperidin-4-yl)amino]pyrazine-2-carboxamide
CID 166507495
1-N,4-N-dimethyl-4-N-(1-methylpiperidin-4-yl)benzene-1,4-diamine
CID 117041410
2,4-difluoro-6-hydroxy-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]benzamide
CID 71883384
6-bromo-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]-2H-benzotriazole-4-carboxamide
CID 166180129
3-[4-(dimethylamino)phenyl]-1-methyl-1-(1-methylpiperidin-4-yl)urea
CID 108894718
(4-cyclobutyl-4-hydroxypiperidin-1-yl)-(2-methylimidazo[1,2-a]pyrazin-8-yl)methanone
CID 167842213
1-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]ethanol
CID 43505995
N-[(1S,3R)-3-[(5-ethyl-1-pentan-3-ylpyrazole-4-carbonyl)amino]cyclopentyl]-2-methylimidazo[1,2-a]pyrazine-8-carboxamide
CID 167846006
methyl 5-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,3-thiazole-4-carboxylate
CID 115423333
N-[4-(dimethylamino)phenyl]-2-[methyl-(1-methylpiperidin-4-yl)amino]acetamide
CID 2095190
N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide
CID 110704495
2,5-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 110862459

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide?
The IUPAC name of 2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide (CID 166228678) is 2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide.
What is the SMILES notation for 2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide?
The canonical SMILES for 2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide is Cc1cn2ccnc(C(=O)Nc3ccc(N(C)C4CCN(C)CC4)cc3)c2n1.
What is the InChIKey of 2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide?
The InChIKey is AOVBQQJWBBUBEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N6O/c1-15-14-27-13-10-22-19(20(27)23-15)21(28)24-16-4-6-17(7-5-16)26(3)18-8-11-25(2)12-9-18/h4-7,10,13-14,18H,8-9,11-12H2,1-3H3,(H,24,28).
What are the key properties of 2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide?
2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide has a molecular weight of 378.48 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-[methyl-(1-methylpiperidin-4-yl)amino]phenyl]imidazo[1,2-a]pyrazine-8-carboxamide is sourced from PubChem (CID 166228678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).