(4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone

C13H13ClN4O — CID 81226550

IUPAC(4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
SMILESCc1cc(Cl)c(C(=O)N2CCn3ccnc3C2)cn1
InChIInChI=1S/C13H13ClN4O/c1-9-6-11(14)10(7-16-9)13(19)18-5-4-17-3-2-15-12(17)8-18/h2-3,6-7H,4-5,8H2,1H3
InChIKeyYHDDCSCEGYJCHS-UHFFFAOYSA-N
MW276.73 g/mol
LogP1.90
Rot. Bonds1

About (4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone

(4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone (PubChem CID 81226550) has the molecular formula C13H13ClN4O and a molecular weight of 276.73 g/mol. Its IUPAC name is (4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone.

Molecular Properties

Compound Name(4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
PubChem CID81226550
Molecular FormulaC13H13ClN4O
Molecular Weight276.73 g/mol
Exact Mass276.08
IUPAC Name(4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
SMILESCc1cc(Cl)c(C(=O)N2CCn3ccnc3C2)cn1
InChIInChI=1S/C13H13ClN4O/c1-9-6-11(14)10(7-16-9)13(19)18-5-4-17-3-2-15-12(17)8-18/h2-3,6-7H,4-5,8H2,1H3
InChIKeyYHDDCSCEGYJCHS-UHFFFAOYSA-N
XLogP1.90
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.73
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone with MolForge

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Related Compounds

6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[4-(ethylamino)-6-methyl-3-pyridinyl]methanone
CID 81237982
[5-chloro-2-(methylamino)-4-pyridinyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 114923448
(4-chloro-2-hydroxyphenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 63026132
(2,6-dichloro-4-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 63015031
(4-chloro-6-methyl-3-pyridinyl)-(1-oxo-1,4-thiazinan-4-yl)methanone
CID 81226375
(4-chloro-6-methyl-3-pyridinyl)-(4-methylpiperidin-1-yl)methanone
CID 81225286
(4-chloro-6-methyl-3-pyridinyl)-(3-hydroxyazetidin-1-yl)methanone
CID 103863071
(4-bromo-3-chlorophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 81002855
methyl 6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate
CID 110712648
(2,4-dibromophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 103882843
6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[3-(ethylamino)-4-pyridinyl]methanone
CID 105069994
6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(3,5-dihydroxyphenyl)methanone
CID 104939006

Frequently Asked Questions

What is the IUPAC name of (4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
The IUPAC name of (4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone (CID 81226550) is (4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone.
What is the SMILES notation for (4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
The canonical SMILES for (4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone is Cc1cc(Cl)c(C(=O)N2CCn3ccnc3C2)cn1.
What is the InChIKey of (4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
The InChIKey is YHDDCSCEGYJCHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN4O/c1-9-6-11(14)10(7-16-9)13(19)18-5-4-17-3-2-15-12(17)8-18/h2-3,6-7H,4-5,8H2,1H3.
What are the key properties of (4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
(4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone has a molecular weight of 276.73 g/mol, XLogP of 1.90, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-6-methyl-3-pyridinyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone is sourced from PubChem (CID 81226550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).