6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine

C14H11N5O2 — CID 137368065

IUPAC6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine
SMILESCc1nc2nc(Nc3ccccc3)cnc2cc1[N+](=O)[O-]
InChIInChI=1S/C14H11N5O2/c1-9-12(19(20)21)7-11-14(16-9)18-13(8-15-11)17-10-5-3-2-4-6-10/h2-8H,1H3,(H,16,17,18)
InChIKeyFWQDFNLDWGPBNZ-UHFFFAOYSA-N
MW281.28 g/mol
LogP2.99
Rot. Bonds3

About 6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine

6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine (PubChem CID 137368065) has the molecular formula C14H11N5O2 and a molecular weight of 281.28 g/mol. Its IUPAC name is 6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine.

Molecular Properties

Compound Name6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine
PubChem CID137368065
Molecular FormulaC14H11N5O2
Molecular Weight281.28 g/mol
Exact Mass281.09
IUPAC Name6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine
SMILESCc1nc2nc(Nc3ccccc3)cnc2cc1[N+](=O)[O-]
InChIInChI=1S/C14H11N5O2/c1-9-12(19(20)21)7-11-14(16-9)18-13(8-15-11)17-10-5-3-2-4-6-10/h2-8H,1H3,(H,16,17,18)
InChIKeyFWQDFNLDWGPBNZ-UHFFFAOYSA-N
XLogP2.99
TPSA93.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.28
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(3-anilino-6-methylpyrido[2,3-b]pyrazin-7-yl)-3-(2-chloro-4-methylphenyl)propan-2-one
CID 159744327
3-nitro-2-N,6-N-diphenylpyridine-2,6-diamine
CID 2783708
N-phenylbenzo[g]quinoxalin-3-amine
CID 5273861
6-methyl-7-nitro-4H-pyrido[2,3-b]pyrazin-3-one
CID 156679912
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CID 121013586
3-N-(4-methyl-5-nitro-2-pyridinyl)benzene-1,3-diamine
CID 79173832
3-nitro-2-N-phenyl-6-N-propylpyridine-2,6-diamine
CID 80768548
4-N-(4-methyl-5-nitro-2-pyridinyl)benzene-1,4-diamine
CID 79173729
6-chloro-7-nitro-N-phenylquinazolin-4-amine
CID 141449304
5-chloro-4-methyl-2-nitro-N-phenylaniline
CID 67032404
4-N-(4,6-dimethylpyrimidin-2-yl)-1-N-quinoxalin-2-ylbenzene-1,4-diamine
CID 108777589
carbon dioxide;4-methyl-2-nitro-N-phenylaniline
CID 91236628

Frequently Asked Questions

What is the IUPAC name of 6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine?
The IUPAC name of 6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine (CID 137368065) is 6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine.
What is the SMILES notation for 6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine?
The canonical SMILES for 6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine is Cc1nc2nc(Nc3ccccc3)cnc2cc1[N+](=O)[O-].
What is the InChIKey of 6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine?
The InChIKey is FWQDFNLDWGPBNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5O2/c1-9-12(19(20)21)7-11-14(16-9)18-13(8-15-11)17-10-5-3-2-4-6-10/h2-8H,1H3,(H,16,17,18).
What are the key properties of 6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine?
6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine has a molecular weight of 281.28 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-7-nitro-N-phenylpyrido[2,3-b]pyrazin-3-amine is sourced from PubChem (CID 137368065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).