N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide

C19H18N4O — CID 102042106

IUPACN-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide
SMILESCN(C)c1ccc(-c2cnc(NC(=O)c3ccccc3)cn2)cc1
InChIInChI=1S/C19H18N4O/c1-23(2)16-10-8-14(9-11-16)17-12-21-18(13-20-17)22-19(24)15-6-4-3-5-7-15/h3-13H,1-2H3,(H,21,22,24)
InChIKeyGSRMWFMECKMPHX-UHFFFAOYSA-N
MW318.38 g/mol
LogP3.46
Rot. Bonds4

About N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide

N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide (PubChem CID 102042106) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide.

Molecular Properties

Compound NameN-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide
PubChem CID102042106
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC NameN-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide
SMILESCN(C)c1ccc(-c2cnc(NC(=O)c3ccccc3)cn2)cc1
InChIInChI=1S/C19H18N4O/c1-23(2)16-10-8-14(9-11-16)17-12-21-18(13-20-17)22-19(24)15-6-4-3-5-7-15/h3-13H,1-2H3,(H,21,22,24)
InChIKeyGSRMWFMECKMPHX-UHFFFAOYSA-N
XLogP3.46
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-pyridin-2-ylpyrazin-2-yl)benzamide
CID 137408648
4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline
CID 102012408
N-[5-[methyl(propyl)amino]-2-pyridinyl]-4-pyridin-2-ylbenzamide
CID 144544551
N-[6-[4-(dimethylamino)anilino]pyridazin-3-yl]benzamide
CID 113049582
N-[5-[2-(dimethylamino)ethyl-methylamino]-2-pyridinyl]benzamide
CID 175915827
N-[4-(5-benzamido-2-pyridinyl)phenyl]benzamide
CID 86766305
N-[5-(4-fluorophenyl)pyrazin-2-yl]acetamide
CID 86081806
ethane;methyl 6-benzamidopyridine-3-carboxylate
CID 91195390
4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide
CID 122302379
N-(2-benzamidoethyl)-4-(dimethylamino)benzamide
CID 38175898
2-chloro-N-[[5-(4-chlorophenyl)pyrazin-2-yl]carbamoyl]benzamide
CID 13341093
4-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
CID 47423237

Frequently Asked Questions

What is the IUPAC name of N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide?
The IUPAC name of N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide (CID 102042106) is N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide.
What is the SMILES notation for N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide?
The canonical SMILES for N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide is CN(C)c1ccc(-c2cnc(NC(=O)c3ccccc3)cn2)cc1.
What is the InChIKey of N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide?
The InChIKey is GSRMWFMECKMPHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O/c1-23(2)16-10-8-14(9-11-16)17-12-21-18(13-20-17)22-19(24)15-6-4-3-5-7-15/h3-13H,1-2H3,(H,21,22,24).
What are the key properties of N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide?
N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide has a molecular weight of 318.38 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide is sourced from PubChem (CID 102042106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).