N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide

C18H25N3O2 — CID 120577841

IUPACN-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
SMILESCC1NCCCC1NC(=O)c1ccc(CN2CCCC2=O)cc1
InChIInChI=1S/C18H25N3O2/c1-13-16(4-2-10-19-13)20-18(23)15-8-6-14(7-9-15)12-21-11-3-5-17(21)22/h6-9,13,16,19H,2-5,10-12H2,1H3,(H,20,23)
InChIKeyAUBVLZLUWLBPEQ-UHFFFAOYSA-N
MW315.42 g/mol
LogP1.68
Rot. Bonds4

About N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide

N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide (PubChem CID 120577841) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide.

Molecular Properties

Compound NameN-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
PubChem CID120577841
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC NameN-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
SMILESCC1NCCCC1NC(=O)c1ccc(CN2CCCC2=O)cc1
InChIInChI=1S/C18H25N3O2/c1-13-16(4-2-10-19-13)20-18(23)15-8-6-14(7-9-15)12-21-11-3-5-17(21)22/h6-9,13,16,19H,2-5,10-12H2,1H3,(H,20,23)
InChIKeyAUBVLZLUWLBPEQ-UHFFFAOYSA-N
XLogP1.68
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(aminomethyl)cyclohexyl]-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 119611457
4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(2-methylpiperidin-3-yl)benzamide
CID 120575807
N-[(2R,3R)-2-methylpiperidin-3-yl]benzamide
CID 124511336
1-N-(2,2-dimethylpropyl)-4-N-(2-methylpiperidin-3-yl)benzene-1,4-dicarboxamide;hydrochloride
CID 120575205
1-[(1S,2R,3R)-2,3-dimethylcyclohexyl]-3-[[4-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]amino]thiourea
CID 11927440
N-methylsulfonyl-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 47232606
4-ethylsulfonyl-N-(2-methylpiperidin-3-yl)benzamide
CID 120574136
4-[(2-oxopyrrolidin-1-yl)methyl]-N-propylbenzamide
CID 32745199
4-[[ethyl(propan-2-yl)amino]methyl]-N-(2-methylpiperidin-3-yl)benzamide;dihydrochloride
CID 120576871
4-[(2-oxopyrrolidin-1-yl)methyl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 32745572
1-[(4-methylphenyl)methyl]-N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride
CID 120574389
N-(2-methylpiperidin-3-yl)-1,3-dioxo-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide;dihydrochloride
CID 120575696

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
The IUPAC name of N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide (CID 120577841) is N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide.
What is the SMILES notation for N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
The canonical SMILES for N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide is CC1NCCCC1NC(=O)c1ccc(CN2CCCC2=O)cc1.
What is the InChIKey of N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
The InChIKey is AUBVLZLUWLBPEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-13-16(4-2-10-19-13)20-18(23)15-8-6-14(7-9-15)12-21-11-3-5-17(21)22/h6-9,13,16,19H,2-5,10-12H2,1H3,(H,20,23).
What are the key properties of N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide has a molecular weight of 315.42 g/mol, XLogP of 1.68, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpiperidin-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide is sourced from PubChem (CID 120577841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).