N-(3-azidopropyl)pyrazine-2-carboxamide

C8H10N6O — CID 62199377

IUPACN-(3-azidopropyl)pyrazine-2-carboxamide
SMILES[N-]=[N+]=NCCCNC(=O)c1cnccn1
InChIInChI=1S/C8H10N6O/c9-14-13-3-1-2-12-8(15)7-6-10-4-5-11-7/h4-6H,1-3H2,(H,12,15)
InChIKeyWWAFQZXKAHKWGS-UHFFFAOYSA-N
MW206.21 g/mol
LogP0.91
Rot. Bonds5

About N-(3-azidopropyl)pyrazine-2-carboxamide

N-(3-azidopropyl)pyrazine-2-carboxamide (PubChem CID 62199377) has the molecular formula C8H10N6O and a molecular weight of 206.21 g/mol. Its IUPAC name is N-(3-azidopropyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(3-azidopropyl)pyrazine-2-carboxamide
PubChem CID62199377
Molecular FormulaC8H10N6O
Molecular Weight206.21 g/mol
Exact Mass206.09
IUPAC NameN-(3-azidopropyl)pyrazine-2-carboxamide
SMILES[N-]=[N+]=NCCCNC(=O)c1cnccn1
InChIInChI=1S/C8H10N6O/c9-14-13-3-1-2-12-8(15)7-6-10-4-5-11-7/h4-6H,1-3H2,(H,12,15)
InChIKeyWWAFQZXKAHKWGS-UHFFFAOYSA-N
XLogP0.91
TPSA103.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.21
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

N-[10-(pyrazine-2-carbonylamino)decyl]pyrazine-2-carboxamide
CID 71517100
N-(5-hydroxypentyl)pyrazine-2-carboxamide
CID 108796814
N-(2-hydroxyethyl)pyrazine-2-carboxamide
CID 14230272
N-pent-4-ynylpyrazine-2-carboxamide
CID 103709111
N-(4-amino-4-hydroxyiminobutyl)pyrazine-2-carboxamide
CID 76953270
N-(3-azidopropyl)-1-methylimidazole-4-carboxamide
CID 107974564
methyl N-[2-(pyrazine-2-carbonylamino)ethyl]carbamate
CID 108574667
N-(3-pyridin-4-ylsulfanylpropyl)pyrazine-2-carboxamide
CID 15231502
N-[3-(1,2,4-triazol-1-yl)propyl]pyrazine-2-carboxamide
CID 51079280
N-[3-[(2-phenoxyacetyl)amino]propyl]pyrazine-2-carboxamide
CID 8990873
N-(2-amino-2-oxoethyl)pyrazine-2-carboxamide
CID 14101204
N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide
CID 51088431

Frequently Asked Questions

What is the IUPAC name of N-(3-azidopropyl)pyrazine-2-carboxamide?
The IUPAC name of N-(3-azidopropyl)pyrazine-2-carboxamide (CID 62199377) is N-(3-azidopropyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(3-azidopropyl)pyrazine-2-carboxamide?
The canonical SMILES for N-(3-azidopropyl)pyrazine-2-carboxamide is [N-]=[N+]=NCCCNC(=O)c1cnccn1.
What is the InChIKey of N-(3-azidopropyl)pyrazine-2-carboxamide?
The InChIKey is WWAFQZXKAHKWGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N6O/c9-14-13-3-1-2-12-8(15)7-6-10-4-5-11-7/h4-6H,1-3H2,(H,12,15).
What are the key properties of N-(3-azidopropyl)pyrazine-2-carboxamide?
N-(3-azidopropyl)pyrazine-2-carboxamide has a molecular weight of 206.21 g/mol, XLogP of 0.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-azidopropyl)pyrazine-2-carboxamide is sourced from PubChem (CID 62199377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).