4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide

C21H20N6O2 — CID 163316845

IUPAC4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide
SMILESCOc1cc(-c2ccc(C(=O)NCc3cn4ccncc4n3)cc2)c(N)nc1C
InChIInChI=1S/C21H20N6O2/c1-13-18(29-2)9-17(20(22)25-13)14-3-5-15(6-4-14)21(28)24-10-16-12-27-8-7-23-11-19(27)26-16/h3-9,11-12H,10H2,1-2H3,(H2,22,25)(H,24,28)
InChIKeySYIMTELJRJORRH-UHFFFAOYSA-N
MW388.43 g/mol
LogP2.62
Rot. Bonds5

About 4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide

4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide (PubChem CID 163316845) has the molecular formula C21H20N6O2 and a molecular weight of 388.43 g/mol. Its IUPAC name is 4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide
PubChem CID163316845
Molecular FormulaC21H20N6O2
Molecular Weight388.43 g/mol
Exact Mass388.16
IUPAC Name4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide
SMILESCOc1cc(-c2ccc(C(=O)NCc3cn4ccncc4n3)cc2)c(N)nc1C
InChIInChI=1S/C21H20N6O2/c1-13-18(29-2)9-17(20(22)25-13)14-3-5-15(6-4-14)21(28)24-10-16-12-27-8-7-23-11-19(27)26-16/h3-9,11-12H,10H2,1-2H3,(H2,22,25)(H,24,28)
InChIKeySYIMTELJRJORRH-UHFFFAOYSA-N
XLogP2.62
TPSA107.43 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.43
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-methylbenzamide
CID 162626905
4-[4-[(7-methylimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]phenoxy]benzamide
CID 56548828
4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-[(3R,4R)-4-methoxyoxan-3-yl]benzamide
CID 163319270
3-(difluoromethoxy)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-methoxybenzamide
CID 47040736
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methoxynaphthalene-2-carboxamide
CID 17397246
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-methoxybenzamide
CID 3658662
3,4,5-triethoxy-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide
CID 8917080
2-[(4-methoxybenzoyl)amino]-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]benzamide
CID 55976559
4-methoxy-N-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl]benzamide
CID 16866605
4-pyridin-3-yl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 59672655
4-[5-[3-methoxy-4-(3-methyl-4-pyridinyl)anilino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)benzamide
CID 177157454
4-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide
CID 35991337

Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide?
The IUPAC name of 4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide (CID 163316845) is 4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide.
What is the SMILES notation for 4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide?
The canonical SMILES for 4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide is COc1cc(-c2ccc(C(=O)NCc3cn4ccncc4n3)cc2)c(N)nc1C.
What is the InChIKey of 4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide?
The InChIKey is SYIMTELJRJORRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N6O2/c1-13-18(29-2)9-17(20(22)25-13)14-3-5-15(6-4-14)21(28)24-10-16-12-27-8-7-23-11-19(27)26-16/h3-9,11-12H,10H2,1-2H3,(H2,22,25)(H,24,28).
What are the key properties of 4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide?
4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide has a molecular weight of 388.43 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)-N-(imidazo[1,2-a]pyrazin-2-ylmethyl)benzamide is sourced from PubChem (CID 163316845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).