N,N'-dibenzyl-N,N'-dimethylpropanediamide

C19H22N2O2 — CID 2392235

IUPACN,N'-dibenzyl-N,N'-dimethylpropanediamide
SMILESCN(Cc1ccccc1)C(=O)CC(=O)N(C)Cc1ccccc1
InChIInChI=1S/C19H22N2O2/c1-20(14-16-9-5-3-6-10-16)18(22)13-19(23)21(2)15-17-11-7-4-8-12-17/h3-12H,13-15H2,1-2H3
InChIKeyXLKJSXXRSQNBJB-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.69
Rot. Bonds6

About N,N'-dibenzyl-N,N'-dimethylpropanediamide

N,N'-dibenzyl-N,N'-dimethylpropanediamide (PubChem CID 2392235) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N,N'-dibenzyl-N,N'-dimethylpropanediamide.

Molecular Properties

Compound NameN,N'-dibenzyl-N,N'-dimethylpropanediamide
PubChem CID2392235
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN,N'-dibenzyl-N,N'-dimethylpropanediamide
SMILESCN(Cc1ccccc1)C(=O)CC(=O)N(C)Cc1ccccc1
InChIInChI=1S/C19H22N2O2/c1-20(14-16-9-5-3-6-10-16)18(22)13-19(23)21(2)15-17-11-7-4-8-12-17/h3-12H,13-15H2,1-2H3
InChIKeyXLKJSXXRSQNBJB-UHFFFAOYSA-N
XLogP2.69
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

N,N'-dibenzyl-N-methyl-N'-propan-2-ylpropanediamide
CID 108946081
3-amino-N-benzyl-3-imino-N-methylpropanamide
CID 99990430
N-benzyl-2-formamido-N-methylacetamide
CID 18618309
N'-benzyl-N'-methyl-N-(pyridin-4-ylmethyl)propanediamide
CID 108946043
N-benzyl-N-methylpentanamide
CID 4629611
N-benzyl-N-methyl-4-(methylamino)butanamide
CID 60842037
3-amino-1-benzyl-1-methylurea
CID 43163959
N-methyl-2-phenyl-N-[(4-phenylphenyl)methyl]acetamide
CID 55580695
3-amino-N-benzyl-N,3-dimethylbutanamide
CID 64684536
N-benzyl-N-methyl-3-(4-methylpiperazin-1-yl)-3-oxopropanamide
CID 108944328
N'-benzyl-N-cyclopentyl-N'-methylpropanediamide
CID 108942140
N-benzyl-N-methyl-3-(propylamino)propanamide
CID 109011497

Frequently Asked Questions

What is the IUPAC name of N,N'-dibenzyl-N,N'-dimethylpropanediamide?
The IUPAC name of N,N'-dibenzyl-N,N'-dimethylpropanediamide (CID 2392235) is N,N'-dibenzyl-N,N'-dimethylpropanediamide.
What is the SMILES notation for N,N'-dibenzyl-N,N'-dimethylpropanediamide?
The canonical SMILES for N,N'-dibenzyl-N,N'-dimethylpropanediamide is CN(Cc1ccccc1)C(=O)CC(=O)N(C)Cc1ccccc1.
What is the InChIKey of N,N'-dibenzyl-N,N'-dimethylpropanediamide?
The InChIKey is XLKJSXXRSQNBJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-20(14-16-9-5-3-6-10-16)18(22)13-19(23)21(2)15-17-11-7-4-8-12-17/h3-12H,13-15H2,1-2H3.
What are the key properties of N,N'-dibenzyl-N,N'-dimethylpropanediamide?
N,N'-dibenzyl-N,N'-dimethylpropanediamide has a molecular weight of 310.40 g/mol, XLogP of 2.69, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dibenzyl-N,N'-dimethylpropanediamide is sourced from PubChem (CID 2392235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).