1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide

C19H20N2O2 — CID 109135783

IUPAC1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide
SMILESCN(Cc1ccccc1)C(=O)C1CC1C(=O)Nc1ccccc1
InChIInChI=1S/C19H20N2O2/c1-21(13-14-8-4-2-5-9-14)19(23)17-12-16(17)18(22)20-15-10-6-3-7-11-15/h2-11,16-17H,12-13H2,1H3,(H,20,22)
InChIKeyXEKQRZDCEAWLCT-UHFFFAOYSA-N
MW308.38 g/mol
LogP2.92
Rot. Bonds5

About 1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide

1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide (PubChem CID 109135783) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide
PubChem CID109135783
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide
SMILESCN(Cc1ccccc1)C(=O)C1CC1C(=O)Nc1ccccc1
InChIInChI=1S/C19H20N2O2/c1-21(13-14-8-4-2-5-9-14)19(23)17-12-16(17)18(22)20-15-10-6-3-7-11-15/h2-11,16-17H,12-13H2,1H3,(H,20,22)
InChIKeyXEKQRZDCEAWLCT-UHFFFAOYSA-N
XLogP2.92
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-benzyl-2-N-(3-bromophenyl)-1-N-methylcyclopropane-1,2-dicarboxamide
CID 109135850
1-N-benzyl-2-N-(3,4-dimethoxyphenyl)-1-N-methylcyclopropane-1,2-dicarboxamide
CID 109135831
1-N-benzyl-2-N-(2,6-diethylphenyl)-1-N-methylcyclopropane-1,2-dicarboxamide
CID 109135803
1-N-benzyl-2-N-(2-tert-butylphenyl)-1-N-methylcyclopropane-1,2-dicarboxamide
CID 109135805
1-N-benzyl-2-N-(2-cyanophenyl)-1-N-methylcyclopropane-1,2-dicarboxamide
CID 109135868
1-N-benzyl-1-N-methyl-2-N-quinolin-8-ylcyclopropane-1,2-dicarboxamide
CID 109135854
1-N-benzyl-2-N-(2-methoxy-5-methylphenyl)-1-N-methylcyclopropane-1,2-dicarboxamide
CID 109135826
1-N-benzyl-2-N-(4-ethylphenyl)-1-N-phenylcyclopropane-1,2-dicarboxamide
CID 109142112
1-N-benzyl-2-N-(3-fluorophenyl)-1-N-phenylcyclopropane-1,2-dicarboxamide
CID 109143982
1-N-benzyl-2-N-(4-tert-butylphenyl)-1-N-propan-2-ylcyclopropane-1,2-dicarboxamide
CID 109139840
1-N,2-N-bis[2-[benzyl(methyl)amino]-2-oxoethyl]cyclopropane-1,2-dicarboxamide
CID 166187022
2-[[4-[(dimethylamino)methyl]phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 54868227

Frequently Asked Questions

What is the IUPAC name of 1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide?
The IUPAC name of 1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide (CID 109135783) is 1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide?
The canonical SMILES for 1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide is CN(Cc1ccccc1)C(=O)C1CC1C(=O)Nc1ccccc1.
What is the InChIKey of 1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide?
The InChIKey is XEKQRZDCEAWLCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-21(13-14-8-4-2-5-9-14)19(23)17-12-16(17)18(22)20-15-10-6-3-7-11-15/h2-11,16-17H,12-13H2,1H3,(H,20,22).
What are the key properties of 1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide?
1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide has a molecular weight of 308.38 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-benzyl-1-N-methyl-2-N-phenylcyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109135783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).