N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide

C19H24N4O — CID 24551928

IUPACN,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide
SMILESCc1cnc(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cn1
InChIInChI=1S/C19H24N4O/c1-15-12-21-18(13-20-15)19(24)22(2)14-16-6-8-17(9-7-16)23-10-4-3-5-11-23/h6-9,12-13H,3-5,10-11,14H2,1-2H3
InChIKeyFLOPQENRGTUQNH-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.05
Rot. Bonds4

About N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide

N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide (PubChem CID 24551928) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide
PubChem CID24551928
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC NameN,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide
SMILESCc1cnc(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cn1
InChIInChI=1S/C19H24N4O/c1-15-12-21-18(13-20-15)19(24)22(2)14-16-6-8-17(9-7-16)23-10-4-3-5-11-23/h6-9,12-13H,3-5,10-11,14H2,1-2H3
InChIKeyFLOPQENRGTUQNH-UHFFFAOYSA-N
XLogP3.05
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

5-(azepan-1-yl)-N-benzyl-N-methylpyrazine-2-carboxamide
CID 109281067
N-benzyl-N-methyl-5-(4-pyrrolidin-1-ylanilino)pyrazine-2-carboxamide
CID 109281129
N-methyl-6-oxo-N-[(4-piperidin-1-ylphenyl)methyl]-1H-pyridazine-3-carboxamide
CID 31660617
N-[4-(azepan-1-yl)phenyl]-5-methylpyrazine-2-carboxamide
CID 51197527
3,4,5-trimethoxy-N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]benzamide
CID 24551923
N-methyl-3-oxo-N-[(4-piperidin-1-ylphenyl)methyl]butanamide
CID 18072731
3-[methyl-[(4-piperidin-1-ylphenyl)methyl]amino]-3-oxopropanoic acid
CID 62231414
N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide
CID 61254195
3-(dimethylamino)-N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]benzamide
CID 24551926
5-(4-acetylpiperazin-1-yl)-N-benzyl-N-methylpyridine-2-carboxamide
CID 109187351
N-benzyl-5-(4-ethylpiperazin-1-yl)-N-methylpyridine-2-carboxamide
CID 109186763
N-methyl-N-[(4-morpholin-4-ylphenyl)methyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide
CID 134013173

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide?
The IUPAC name of N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide (CID 24551928) is N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide is Cc1cnc(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cn1.
What is the InChIKey of N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide?
The InChIKey is FLOPQENRGTUQNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-15-12-21-18(13-20-15)19(24)22(2)14-16-6-8-17(9-7-16)23-10-4-3-5-11-23/h6-9,12-13H,3-5,10-11,14H2,1-2H3.
What are the key properties of N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide?
N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide has a molecular weight of 324.43 g/mol, XLogP of 3.05, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 24551928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).