N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine

C19H13ClN4 — CID 22725052

IUPACN-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine
SMILESClc1cccc(Nc2ccc3ncc(-c4ccccc4)nc3n2)c1
InChIInChI=1S/C19H13ClN4/c20-14-7-4-8-15(11-14)22-18-10-9-16-19(24-18)23-17(12-21-16)13-5-2-1-3-6-13/h1-12H,(H,22,23,24)
InChIKeyQCPKHOKMOYDCRB-UHFFFAOYSA-N
MW332.79 g/mol
LogP5.09
Rot. Bonds3

About N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine

N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine (PubChem CID 22725052) has the molecular formula C19H13ClN4 and a molecular weight of 332.79 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine
PubChem CID22725052
Molecular FormulaC19H13ClN4
Molecular Weight332.79 g/mol
Exact Mass332.08
IUPAC NameN-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine
SMILESClc1cccc(Nc2ccc3ncc(-c4ccccc4)nc3n2)c1
InChIInChI=1S/C19H13ClN4/c20-14-7-4-8-15(11-14)22-18-10-9-16-19(24-18)23-17(12-21-16)13-5-2-1-3-6-13/h1-12H,(H,22,23,24)
InChIKeyQCPKHOKMOYDCRB-UHFFFAOYSA-N
XLogP5.09
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.79
LogP ≤ 55.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine?
The IUPAC name of N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine (CID 22725052) is N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine.
What is the SMILES notation for N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine?
The canonical SMILES for N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine is Clc1cccc(Nc2ccc3ncc(-c4ccccc4)nc3n2)c1.
What is the InChIKey of N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine?
The InChIKey is QCPKHOKMOYDCRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13ClN4/c20-14-7-4-8-15(11-14)22-18-10-9-16-19(24-18)23-17(12-21-16)13-5-2-1-3-6-13/h1-12H,(H,22,23,24).
What are the key properties of N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine?
N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine has a molecular weight of 332.79 g/mol, XLogP of 5.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-3-phenylpyrido[2,3-b]pyrazin-6-amine is sourced from PubChem (CID 22725052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).