N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide

C19H20N6O — CID 136577610

IUPACN-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
SMILESO=C(Nc1ccc(-c2cnc[nH]2)cc1)C1CCN(c2cnccn2)CC1
InChIInChI=1S/C19H20N6O/c26-19(15-5-9-25(10-6-15)18-12-20-7-8-22-18)24-16-3-1-14(2-4-16)17-11-21-13-23-17/h1-4,7-8,11-13,15H,5-6,9-10H2,(H,21,23)(H,24,26)
InChIKeyMJNYOSQZRPEIGE-UHFFFAOYSA-N
MW348.41 g/mol
LogP2.72
Rot. Bonds4

About N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide

N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide (PubChem CID 136577610) has the molecular formula C19H20N6O and a molecular weight of 348.41 g/mol. Its IUPAC name is N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
PubChem CID136577610
Molecular FormulaC19H20N6O
Molecular Weight348.41 g/mol
Exact Mass348.17
IUPAC NameN-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
SMILESO=C(Nc1ccc(-c2cnc[nH]2)cc1)C1CCN(c2cnccn2)CC1
InChIInChI=1S/C19H20N6O/c26-19(15-5-9-25(10-6-15)18-12-20-7-8-22-18)24-16-3-1-14(2-4-16)17-11-21-13-23-17/h1-4,7-8,11-13,15H,5-6,9-10H2,(H,21,23)(H,24,26)
InChIKeyMJNYOSQZRPEIGE-UHFFFAOYSA-N
XLogP2.72
TPSA86.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(1H-imidazol-5-yl)phenyl]cyclohexanecarboxamide
CID 110471674
N-[4-[5-(aminomethyl)-1H-1,2,4-triazol-3-yl]phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 120566735
N-[4-(methylcarbamoyl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 38797507
4-amino-N-[4-(1H-imidazol-5-yl)phenyl]cyclohexane-1-carboxamide
CID 60849609
N-[(4-acetamidophenyl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 38797292
N-[4-(1H-imidazol-5-yl)phenyl]-1-[2-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyrimidin-4-yl]piperidine-4-carboxamide
CID 91950637
N-[4-(2,4-dimethylphenyl)sulfanylphenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 30840212
3-chloro-5-[(1-pyrazin-2-ylpiperidine-4-carbonyl)amino]benzoic acid
CID 126794812
N-(2-chloro-1,3-benzothiazol-6-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 166239062
N-(1H-benzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 38790029
N-[1-(difluoromethyl)indol-6-yl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 166244884
N-naphthalen-1-yl-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 43815622

Frequently Asked Questions

What is the IUPAC name of N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide?
The IUPAC name of N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide (CID 136577610) is N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide?
The canonical SMILES for N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide is O=C(Nc1ccc(-c2cnc[nH]2)cc1)C1CCN(c2cnccn2)CC1.
What is the InChIKey of N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide?
The InChIKey is MJNYOSQZRPEIGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O/c26-19(15-5-9-25(10-6-15)18-12-20-7-8-22-18)24-16-3-1-14(2-4-16)17-11-21-13-23-17/h1-4,7-8,11-13,15H,5-6,9-10H2,(H,21,23)(H,24,26).
What are the key properties of N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide?
N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide has a molecular weight of 348.41 g/mol, XLogP of 2.72, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1H-imidazol-5-yl)phenyl]-1-pyrazin-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 136577610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).