N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide

C21H18ClN5O — CID 53039715

IUPACN-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide
SMILESO=C(CCNc1c(-c2ccccc2)nc2cnccn12)Nc1ccccc1Cl
InChIInChI=1S/C21H18ClN5O/c22-16-8-4-5-9-17(16)25-19(28)10-11-24-21-20(15-6-2-1-3-7-15)26-18-14-23-12-13-27(18)21/h1-9,12-14,24H,10-11H2,(H,25,28)
InChIKeyHOOBLAGOOCBRAE-UHFFFAOYSA-N
MW391.86 g/mol
LogP4.49
Rot. Bonds6

About N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide

N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide (PubChem CID 53039715) has the molecular formula C21H18ClN5O and a molecular weight of 391.86 g/mol. Its IUPAC name is N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide
PubChem CID53039715
Molecular FormulaC21H18ClN5O
Molecular Weight391.86 g/mol
Exact Mass391.12
IUPAC NameN-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide
SMILESO=C(CCNc1c(-c2ccccc2)nc2cnccn12)Nc1ccccc1Cl
InChIInChI=1S/C21H18ClN5O/c22-16-8-4-5-9-17(16)25-19(28)10-11-24-21-20(15-6-2-1-3-7-15)26-18-14-23-12-13-27(18)21/h1-9,12-14,24H,10-11H2,(H,25,28)
InChIKeyHOOBLAGOOCBRAE-UHFFFAOYSA-N
XLogP4.49
TPSA71.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.86
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[[2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-N-(2-methoxyphenyl)propanamide
CID 53039769
N-(3-fluoro-2-methylphenyl)-3-[[2-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide
CID 53039953
N-(3,5-dimethylphenyl)-3-[[2-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide
CID 53039920
N-(3-chloro-2-methylphenyl)-2-phenylimidazo[1,2-a]pyrazin-3-amine
CID 53032460
1-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propan-1-one
CID 53039725
N-[(methylideneamino)methyl]-2-phenylimidazo[1,2-a]pyrazin-3-amine
CID 143363755
N-benzyl-N-methyl-3-[[2-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide
CID 53039837
N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide
CID 53039989
N-benzyl-3-[[2-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-N-methylpropanamide
CID 53040053
1-(azepan-1-yl)-3-[[2-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one
CID 53040031
3-[[2-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-piperidin-1-ylpropan-1-one
CID 53039915
3-(2-nitroanilino)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 55513544

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide?
The IUPAC name of N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide (CID 53039715) is N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide.
What is the SMILES notation for N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide?
The canonical SMILES for N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide is O=C(CCNc1c(-c2ccccc2)nc2cnccn12)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide?
The InChIKey is HOOBLAGOOCBRAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClN5O/c22-16-8-4-5-9-17(16)25-19(28)10-11-24-21-20(15-6-2-1-3-7-15)26-18-14-23-12-13-27(18)21/h1-9,12-14,24H,10-11H2,(H,25,28).
What are the key properties of N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide?
N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide has a molecular weight of 391.86 g/mol, XLogP of 4.49, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propanamide is sourced from PubChem (CID 53039715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).