N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide

C13H14ClN5O — CID 86774611

IUPACN-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide
SMILESO=C(CN1CCn2ccnc2C1)Nc1ccc(Cl)cn1
InChIInChI=1S/C13H14ClN5O/c14-10-1-2-11(16-7-10)17-13(20)9-18-5-6-19-4-3-15-12(19)8-18/h1-4,7H,5-6,8-9H2,(H,16,17,20)
InChIKeyJBGPSJYBRBQNFS-UHFFFAOYSA-N
MW291.74 g/mol
LogP1.39
Rot. Bonds3

About N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide

N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide (PubChem CID 86774611) has the molecular formula C13H14ClN5O and a molecular weight of 291.74 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide
PubChem CID86774611
Molecular FormulaC13H14ClN5O
Molecular Weight291.74 g/mol
Exact Mass291.09
IUPAC NameN-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide
SMILESO=C(CN1CCn2ccnc2C1)Nc1ccc(Cl)cn1
InChIInChI=1S/C13H14ClN5O/c14-10-1-2-11(16-7-10)17-13(20)9-18-5-6-19-4-3-15-12(19)8-18/h1-4,7H,5-6,8-9H2,(H,16,17,20)
InChIKeyJBGPSJYBRBQNFS-UHFFFAOYSA-N
XLogP1.39
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide (CID 86774611) is N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide is O=C(CN1CCn2ccnc2C1)Nc1ccc(Cl)cn1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide?
The InChIKey is JBGPSJYBRBQNFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN5O/c14-10-1-2-11(16-7-10)17-13(20)9-18-5-6-19-4-3-15-12(19)8-18/h1-4,7H,5-6,8-9H2,(H,16,17,20).
What are the key properties of N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide?
N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide has a molecular weight of 291.74 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide is sourced from PubChem (CID 86774611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).