N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide

C22H19F2N5O2 — CID 53039989

IUPACN-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide
SMILESCOc1ccccc1-c1nc2cnccn2c1NCCC(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C22H19F2N5O2/c1-31-18-5-3-2-4-15(18)21-22(29-11-10-25-13-19(29)28-21)26-9-8-20(30)27-14-6-7-16(23)17(24)12-14/h2-7,10-13,26H,8-9H2,1H3,(H,27,30)
InChIKeyIZCUWZGNYYJXOK-UHFFFAOYSA-N
MW423.42 g/mol
LogP4.12
Rot. Bonds7

About N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide

N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide (PubChem CID 53039989) has the molecular formula C22H19F2N5O2 and a molecular weight of 423.42 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide
PubChem CID53039989
Molecular FormulaC22H19F2N5O2
Molecular Weight423.42 g/mol
Exact Mass423.15
IUPAC NameN-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide
SMILESCOc1ccccc1-c1nc2cnccn2c1NCCC(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C22H19F2N5O2/c1-31-18-5-3-2-4-15(18)21-22(29-11-10-25-13-19(29)28-21)26-9-8-20(30)27-14-6-7-16(23)17(24)12-14/h2-7,10-13,26H,8-9H2,1H3,(H,27,30)
InChIKeyIZCUWZGNYYJXOK-UHFFFAOYSA-N
XLogP4.12
TPSA80.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.42
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-[[2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-N-(2-methoxyphenyl)propanamide
CID 53039769
3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one
CID 53039983
N-(3,5-dimethylphenyl)-3-[[2-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide
CID 53039920
N-(3-fluoro-2-methylphenyl)-3-[[2-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide
CID 53039953
N-[(3-chloro-4-fluorophenyl)methyl]-3-[[2-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide
CID 53039875
3-(3,4-difluoroanilino)-N-(3,4-dimethoxyphenyl)propanamide
CID 109040581
N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide
CID 53039715
N-(3,4-difluorophenyl)-3-[(2-methoxyphenyl)methylamino]propanamide
CID 109022256
N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]butanamide
CID 42693874
N-(3,4-difluorophenyl)-2-[[6-(2-methoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl]acetamide
CID 40982460
3-[[2-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-piperidin-1-ylpropan-1-one
CID 53039884
2-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol
CID 135674529

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide?
The IUPAC name of N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide (CID 53039989) is N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide?
The canonical SMILES for N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide is COc1ccccc1-c1nc2cnccn2c1NCCC(=O)Nc1ccc(F)c(F)c1.
What is the InChIKey of N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide?
The InChIKey is IZCUWZGNYYJXOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19F2N5O2/c1-31-18-5-3-2-4-15(18)21-22(29-11-10-25-13-19(29)28-21)26-9-8-20(30)27-14-6-7-16(23)17(24)12-14/h2-7,10-13,26H,8-9H2,1H3,(H,27,30).
What are the key properties of N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide?
N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide has a molecular weight of 423.42 g/mol, XLogP of 4.12, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide is sourced from PubChem (CID 53039989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).