5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one

C19H14Cl2N4O — CID 72710852

IUPAC5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one
SMILESCc1nc2cnc(-c3ccc(=O)[nH]c3)cn2c1Cc1cc(Cl)ccc1Cl
InChIInChI=1S/C19H14Cl2N4O/c1-11-17(7-13-6-14(20)3-4-15(13)21)25-10-16(22-9-18(25)24-11)12-2-5-19(26)23-8-12/h2-6,8-10H,7H2,1H3,(H,23,26)
InChIKeyDVZBWROTVKUZBP-UHFFFAOYSA-N
MW385.25 g/mol
LogP4.29
Rot. Bonds3

About 5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one

5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one (PubChem CID 72710852) has the molecular formula C19H14Cl2N4O and a molecular weight of 385.25 g/mol. Its IUPAC name is 5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one
PubChem CID72710852
Molecular FormulaC19H14Cl2N4O
Molecular Weight385.25 g/mol
Exact Mass384.05
IUPAC Name5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one
SMILESCc1nc2cnc(-c3ccc(=O)[nH]c3)cn2c1Cc1cc(Cl)ccc1Cl
InChIInChI=1S/C19H14Cl2N4O/c1-11-17(7-13-6-14(20)3-4-15(13)21)25-10-16(22-9-18(25)24-11)12-2-5-19(26)23-8-12/h2-6,8-10H,7H2,1H3,(H,23,26)
InChIKeyDVZBWROTVKUZBP-UHFFFAOYSA-N
XLogP4.29
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.25
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one?
The IUPAC name of 5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one (CID 72710852) is 5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one.
What is the SMILES notation for 5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one?
The canonical SMILES for 5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one is Cc1nc2cnc(-c3ccc(=O)[nH]c3)cn2c1Cc1cc(Cl)ccc1Cl.
What is the InChIKey of 5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one?
The InChIKey is DVZBWROTVKUZBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2N4O/c1-11-17(7-13-6-14(20)3-4-15(13)21)25-10-16(22-9-18(25)24-11)12-2-5-19(26)23-8-12/h2-6,8-10H,7H2,1H3,(H,23,26).
What are the key properties of 5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one?
5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one has a molecular weight of 385.25 g/mol, XLogP of 4.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazo[1,2-a]pyrazin-6-yl]-1H-pyridin-2-one is sourced from PubChem (CID 72710852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).