N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide

C13H16N6O — CID 166095172

IUPACN-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide
SMILESO=C(NC1CCNC(n2ccnc2)C1)c1cnccn1
InChIInChI=1S/C13H16N6O/c20-13(11-8-14-3-4-16-11)18-10-1-2-17-12(7-10)19-6-5-15-9-19/h3-6,8-10,12,17H,1-2,7H2,(H,18,20)
InChIKeyYCFFYIWEYVDTJQ-UHFFFAOYSA-N
MW272.31 g/mol
LogP0.35
Rot. Bonds3

About N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide

N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide (PubChem CID 166095172) has the molecular formula C13H16N6O and a molecular weight of 272.31 g/mol. Its IUPAC name is N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide
PubChem CID166095172
Molecular FormulaC13H16N6O
Molecular Weight272.31 g/mol
Exact Mass272.14
IUPAC NameN-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide
SMILESO=C(NC1CCNC(n2ccnc2)C1)c1cnccn1
InChIInChI=1S/C13H16N6O/c20-13(11-8-14-3-4-16-11)18-10-1-2-17-12(7-10)19-6-5-15-9-19/h3-6,8-10,12,17H,1-2,7H2,(H,18,20)
InChIKeyYCFFYIWEYVDTJQ-UHFFFAOYSA-N
XLogP0.35
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide?
The IUPAC name of N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide (CID 166095172) is N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide?
The canonical SMILES for N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide is O=C(NC1CCNC(n2ccnc2)C1)c1cnccn1.
What is the InChIKey of N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide?
The InChIKey is YCFFYIWEYVDTJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N6O/c20-13(11-8-14-3-4-16-11)18-10-1-2-17-12(7-10)19-6-5-15-9-19/h3-6,8-10,12,17H,1-2,7H2,(H,18,20).
What are the key properties of N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide?
N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide has a molecular weight of 272.31 g/mol, XLogP of 0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazol-1-ylpiperidin-4-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 166095172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).