N-pyrrolo[2,3-b]pyrazin-1-ylformamide

C7H6N4O — CID 174673166

IUPACN-pyrrolo[2,3-b]pyrazin-1-ylformamide
SMILESO=CNn1ccnc2nccc1-2
InChIInChI=1S/C7H6N4O/c12-5-10-11-4-3-9-7-6(11)1-2-8-7/h1-5H,(H,10,12)
InChIKeyPXHIFAMZAICGOE-UHFFFAOYSA-N
MW162.15 g/mol
LogP0.08
Rot. Bonds2

About N-pyrrolo[2,3-b]pyrazin-1-ylformamide

N-pyrrolo[2,3-b]pyrazin-1-ylformamide (PubChem CID 174673166) has the molecular formula C7H6N4O and a molecular weight of 162.15 g/mol. Its IUPAC name is N-pyrrolo[2,3-b]pyrazin-1-ylformamide.

Molecular Properties

Compound NameN-pyrrolo[2,3-b]pyrazin-1-ylformamide
PubChem CID174673166
Molecular FormulaC7H6N4O
Molecular Weight162.15 g/mol
Exact Mass162.05
IUPAC NameN-pyrrolo[2,3-b]pyrazin-1-ylformamide
SMILESO=CNn1ccnc2nccc1-2
InChIInChI=1S/C7H6N4O/c12-5-10-11-4-3-9-7-6(11)1-2-8-7/h1-5H,(H,10,12)
InChIKeyPXHIFAMZAICGOE-UHFFFAOYSA-N
XLogP0.08
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.15
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-ethenylpyrrolo[2,3-b]pyrazine
CID 175776939
pyrrolo[2,3-b]pyrazine-1-carboxamide
CID 174673167
N-(2-aminopyrrol-1-yl)formamide
CID 175089251
N-(2-oxo-1,3-thiazol-3-yl)formamide
CID 174982585
4-bromopyrrolo[3,2-b]pyridine
CID 141375457
1,5,8,11-tetrazatricyclo[5.2.2.02,6]undeca-2,4,6,8,10-pentaene
CID 131853054
1-[2-(2-methylimidazol-1-yl)ethyl]imidazole-2-carbaldehyde
CID 62223868
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]formamide
CID 64992462
1-bromoimidazole-2-carbaldehyde
CID 174800704
2-(2-tert-butylpyrazol-3-yl)pyrimidine
CID 56956113
3-(2-methylpyrazol-3-yl)furan-2-carbaldehyde
CID 106886490
2-[[(1-methylimidazol-2-yl)methylamino]methyl]furan-3-carboxylic acid
CID 103251735

Frequently Asked Questions

What is the IUPAC name of N-pyrrolo[2,3-b]pyrazin-1-ylformamide?
The IUPAC name of N-pyrrolo[2,3-b]pyrazin-1-ylformamide (CID 174673166) is N-pyrrolo[2,3-b]pyrazin-1-ylformamide.
What is the SMILES notation for N-pyrrolo[2,3-b]pyrazin-1-ylformamide?
The canonical SMILES for N-pyrrolo[2,3-b]pyrazin-1-ylformamide is O=CNn1ccnc2nccc1-2.
What is the InChIKey of N-pyrrolo[2,3-b]pyrazin-1-ylformamide?
The InChIKey is PXHIFAMZAICGOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N4O/c12-5-10-11-4-3-9-7-6(11)1-2-8-7/h1-5H,(H,10,12).
What are the key properties of N-pyrrolo[2,3-b]pyrazin-1-ylformamide?
N-pyrrolo[2,3-b]pyrazin-1-ylformamide has a molecular weight of 162.15 g/mol, XLogP of 0.08, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrrolo[2,3-b]pyrazin-1-ylformamide is sourced from PubChem (CID 174673166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).