5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide

C14H19N3O2 — CID 64655482

IUPAC5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
SMILESCc1ccc(N)cc1C(=O)NC1CCC(=O)N(C)C1
InChIInChI=1S/C14H19N3O2/c1-9-3-4-10(15)7-12(9)14(19)16-11-5-6-13(18)17(2)8-11/h3-4,7,11H,5-6,8,15H2,1-2H3,(H,16,19)
InChIKeyALUVYDMWFUWASN-UHFFFAOYSA-N
MW261.32 g/mol
LogP0.93
Rot. Bonds2

About 5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide

5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide (PubChem CID 64655482) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide.

Molecular Properties

Compound Name5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
PubChem CID64655482
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
SMILESCc1ccc(N)cc1C(=O)NC1CCC(=O)N(C)C1
InChIInChI=1S/C14H19N3O2/c1-9-3-4-10(15)7-12(9)14(19)16-11-5-6-13(18)17(2)8-11/h3-4,7,11H,5-6,8,15H2,1-2H3,(H,16,19)
InChIKeyALUVYDMWFUWASN-UHFFFAOYSA-N
XLogP0.93
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-2-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 64656087
2-amino-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 64655074
2-bromo-4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 103765334
3-amino-2,4-dichloro-N-[(3S)-1-methyl-6-oxopiperidin-3-yl]benzamide
CID 100756034
3-amino-2-chloro-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 112575976
4-bromo-2-hydroxy-N-[(3S)-1-methyl-6-oxopiperidin-3-yl]benzamide
CID 96505596
4-amino-2-[(1-methyl-6-oxopiperidin-3-yl)amino]benzamide
CID 64654110
5-amino-2-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)benzamide;dihydrochloride
CID 120647242
2-bromo-N-(1-methyl-6-oxopiperidin-3-yl)furan-3-carboxamide
CID 106854038
2-hydroxy-5-methoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 64668039
5-chloro-2-(ethylamino)-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 64667455
5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide
CID 61466325

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide?
The IUPAC name of 5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide (CID 64655482) is 5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide.
What is the SMILES notation for 5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide?
The canonical SMILES for 5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide is Cc1ccc(N)cc1C(=O)NC1CCC(=O)N(C)C1.
What is the InChIKey of 5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide?
The InChIKey is ALUVYDMWFUWASN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-9-3-4-10(15)7-12(9)14(19)16-11-5-6-13(18)17(2)8-11/h3-4,7,11H,5-6,8,15H2,1-2H3,(H,16,19).
What are the key properties of 5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide?
5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide has a molecular weight of 261.32 g/mol, XLogP of 0.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)benzamide is sourced from PubChem (CID 64655482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).