N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide

C17H18N6O — CID 38790029

IUPACN-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide
SMILESO=C(Nc1nc2ccccc2[nH]1)C1CCN(c2cnccn2)CC1
InChIInChI=1S/C17H18N6O/c24-16(22-17-20-13-3-1-2-4-14(13)21-17)12-5-9-23(10-6-12)15-11-18-7-8-19-15/h1-4,7-8,11-12H,5-6,9-10H2,(H2,20,21,22,24)
InChIKeyLHZFUDZHIVVLSV-UHFFFAOYSA-N
MW322.37 g/mol
LogP2.21
Rot. Bonds3

About N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide

N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide (PubChem CID 38790029) has the molecular formula C17H18N6O and a molecular weight of 322.37 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide
PubChem CID38790029
Molecular FormulaC17H18N6O
Molecular Weight322.37 g/mol
Exact Mass322.15
IUPAC NameN-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide
SMILESO=C(Nc1nc2ccccc2[nH]1)C1CCN(c2cnccn2)CC1
InChIInChI=1S/C17H18N6O/c24-16(22-17-20-13-3-1-2-4-14(13)21-17)12-5-9-23(10-6-12)15-11-18-7-8-19-15/h1-4,7-8,11-12H,5-6,9-10H2,(H2,20,21,22,24)
InChIKeyLHZFUDZHIVVLSV-UHFFFAOYSA-N
XLogP2.21
TPSA86.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-(1-pyrazin-2-ylpiperidin-4-yl)methanone
CID 134053570
N-naphthalen-1-yl-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 43815622
N-(1H-benzimidazol-2-yl)-4-hydroxycyclohexane-1-carboxamide
CID 112528043
N-(1H-benzimidazol-2-yl)-1-(methylsulfamoyl)piperidine-4-carboxamide
CID 146124527
N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide
CID 38793783
N-(1H-benzimidazol-2-yl)bicyclo[4.1.0]heptane-7-carboxamide
CID 79140104
N-(1H-benzimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide
CID 47154418
N-[4-(methylcarbamoyl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 38797507
N-(2,4-difluorophenyl)-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 3222644
N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 136577610
3-oxo-N-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-4H-quinoxaline-2-carboxamide
CID 99932155
N-(1H-benzimidazol-2-yl)-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide
CID 47044809

Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide?
The IUPAC name of N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide (CID 38790029) is N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide?
The canonical SMILES for N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide is O=C(Nc1nc2ccccc2[nH]1)C1CCN(c2cnccn2)CC1.
What is the InChIKey of N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide?
The InChIKey is LHZFUDZHIVVLSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N6O/c24-16(22-17-20-13-3-1-2-4-14(13)21-17)12-5-9-23(10-6-12)15-11-18-7-8-19-15/h1-4,7-8,11-12H,5-6,9-10H2,(H2,20,21,22,24).
What are the key properties of N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide?
N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide has a molecular weight of 322.37 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 38790029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).