N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide

C10H12N4O2 — CID 43594248

IUPACN-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide
SMILESO=C(NC1C2CNCC21)c1c[nH]c(=O)cn1
InChIInChI=1S/C10H12N4O2/c15-8-4-12-7(3-13-8)10(16)14-9-5-1-11-2-6(5)9/h3-6,9,11H,1-2H2,(H,13,15)(H,14,16)
InChIKeyAOCWCKYWOMYTPW-UHFFFAOYSA-N
MW220.23 g/mol
LogP-1.28
Rot. Bonds2

About N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide

N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide (PubChem CID 43594248) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide
PubChem CID43594248
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC NameN-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide
SMILESO=C(NC1C2CNCC21)c1c[nH]c(=O)cn1
InChIInChI=1S/C10H12N4O2/c15-8-4-12-7(3-13-8)10(16)14-9-5-1-11-2-6(5)9/h3-6,9,11H,1-2H2,(H,13,15)(H,14,16)
InChIKeyAOCWCKYWOMYTPW-UHFFFAOYSA-N
XLogP-1.28
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 5-1.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(3R,4S)-3-amino-4-propylpyrrolidine-1-carbonyl]-1H-pyrazin-2-one
CID 72925848
6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide
CID 43167653
5-(4-aminopiperidine-1-carbonyl)-1H-pyrazin-2-one
CID 43556262
N-methyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide
CID 43602008
N-ethyl-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide
CID 54923776
5-[3-(methylaminomethyl)pyrrolidine-1-carbonyl]-1H-pyrazin-2-one
CID 55170198
5-hydroxy-N-[(1-isobutylpiperidin-3-yl)methyl]pyrazine-2-carboxamide
CID 56711357
N-[(1-butylpyrrolidin-3-yl)methyl]-6-oxo-1H-pyrazine-3-carboxamide
CID 56712083
N-(2-amino-2-oxoethyl)-6-oxo-N-piperidin-4-yl-1H-pyrazine-3-carboxamide
CID 60799810
6-oxo-N-piperidin-4-yl-N-propyl-1H-pyrazine-3-carboxamide
CID 60805235
5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one
CID 60978819
5-[3-(methylaminomethyl)piperidine-1-carbonyl]-1H-pyrazin-2-one
CID 61204137

Frequently Asked Questions

What is the IUPAC name of N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide?
The IUPAC name of N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide (CID 43594248) is N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide.
What is the SMILES notation for N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide?
The canonical SMILES for N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide is O=C(NC1C2CNCC21)c1c[nH]c(=O)cn1.
What is the InChIKey of N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide?
The InChIKey is AOCWCKYWOMYTPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c15-8-4-12-7(3-13-8)10(16)14-9-5-1-11-2-6(5)9/h3-6,9,11H,1-2H2,(H,13,15)(H,14,16).
What are the key properties of N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide?
N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide has a molecular weight of 220.23 g/mol, XLogP of -1.28, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-azabicyclo[3.1.0]hexan-6-yl)-6-oxo-1H-pyrazine-3-carboxamide is sourced from PubChem (CID 43594248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).