N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide

C14H20N2O — CID 63373062

IUPACN-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide
SMILESCN1CCC(CN(C)C(=O)c2ccccc2)C1
InChIInChI=1S/C14H20N2O/c1-15-9-8-12(10-15)11-16(2)14(17)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3
InChIKeyXIGDTNVGEDNZTN-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.71
Rot. Bonds3

About N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide

N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide (PubChem CID 63373062) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide.

Molecular Properties

Compound NameN-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide
PubChem CID63373062
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide
SMILESCN1CCC(CN(C)C(=O)c2ccccc2)C1
InChIInChI=1S/C14H20N2O/c1-15-9-8-12(10-15)11-16(2)14(17)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3
InChIKeyXIGDTNVGEDNZTN-UHFFFAOYSA-N
XLogP1.71
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-hydroxy-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide
CID 55170280
N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]-3-sulfanylbenzamide
CID 107029608
4-(chloromethyl)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide
CID 63275957
4-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide
CID 63274929
5-[methyl-[(1-methylpyrrolidin-3-yl)methyl]carbamoyl]pyridine-2-carboxylic acid
CID 63274999
4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide
CID 63236434
2-amino-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]-2-phenylpropanamide
CID 63273840
N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]-1H-indole-6-carboxamide
CID 63373207
N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103765252
N-methyl-N-[[(3R)-1-methylpiperidin-3-yl]methyl]-4-oxo-4-phenylbutanamide
CID 95208686
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-4-(phenylsulfamoyl)benzamide
CID 118720903
4-isocyano-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide
CID 123896887

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide?
The IUPAC name of N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide (CID 63373062) is N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide.
What is the SMILES notation for N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide?
The canonical SMILES for N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide is CN1CCC(CN(C)C(=O)c2ccccc2)C1.
What is the InChIKey of N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide?
The InChIKey is XIGDTNVGEDNZTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-15-9-8-12(10-15)11-16(2)14(17)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3.
What are the key properties of N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide?
N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide has a molecular weight of 232.33 g/mol, XLogP of 1.71, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzamide is sourced from PubChem (CID 63373062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).