3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide

C7H10ClN5 — CID 121202911

IUPAC3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide
SMILES[H]/N=C(\N)N1CCn2c(Cl)cnc2C1
InChIInChI=1S/C7H10ClN5/c8-5-3-11-6-4-12(7(9)10)1-2-13(5)6/h3H,1-2,4H2,(H3,9,10)
InChIKeyDDBVICXFTJIPTC-UHFFFAOYSA-N
MW199.65 g/mol
LogP0.25
Rot. Bonds

About 3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide

3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide (PubChem CID 121202911) has the molecular formula C7H10ClN5 and a molecular weight of 199.65 g/mol. Its IUPAC name is 3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide.

Molecular Properties

Compound Name3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide
PubChem CID121202911
Molecular FormulaC7H10ClN5
Molecular Weight199.65 g/mol
Exact Mass199.06
IUPAC Name3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide
SMILES[H]/N=C(\N)N1CCn2c(Cl)cnc2C1
InChIInChI=1S/C7H10ClN5/c8-5-3-11-6-4-12(7(9)10)1-2-13(5)6/h3H,1-2,4H2,(H3,9,10)
InChIKeyDDBVICXFTJIPTC-UHFFFAOYSA-N
XLogP0.25
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.65
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide?
The IUPAC name of 3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide (CID 121202911) is 3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide.
What is the SMILES notation for 3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide?
The canonical SMILES for 3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide is [H]/N=C(\N)N1CCn2c(Cl)cnc2C1.
What is the InChIKey of 3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide?
The InChIKey is DDBVICXFTJIPTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN5/c8-5-3-11-6-4-12(7(9)10)1-2-13(5)6/h3H,1-2,4H2,(H3,9,10).
What are the key properties of 3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide?
3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide has a molecular weight of 199.65 g/mol, XLogP of 0.25, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboximidamide is sourced from PubChem (CID 121202911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).