4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide

C19H20N2O2 — CID 33351912

IUPAC4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide
SMILESCNC(=O)c1ccc(CN(C(=O)c2ccccc2)C2CC2)cc1
InChIInChI=1S/C19H20N2O2/c1-20-18(22)15-9-7-14(8-10-15)13-21(17-11-12-17)19(23)16-5-3-2-4-6-16/h2-10,17H,11-13H2,1H3,(H,20,22)
InChIKeyMONRTIDATPQJAS-UHFFFAOYSA-N
MW308.38 g/mol
LogP2.85
Rot. Bonds5

About 4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide

4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide (PubChem CID 33351912) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide.

Molecular Properties

Compound Name4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide
PubChem CID33351912
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide
SMILESCNC(=O)c1ccc(CN(C(=O)c2ccccc2)C2CC2)cc1
InChIInChI=1S/C19H20N2O2/c1-20-18(22)15-9-7-14(8-10-15)13-21(17-11-12-17)19(23)16-5-3-2-4-6-16/h2-10,17H,11-13H2,1H3,(H,20,22)
InChIKeyMONRTIDATPQJAS-UHFFFAOYSA-N
XLogP2.85
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 ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[cyclopropyl-(4-methylsulfonylbenzoyl)amino]methyl]-N-methylbenzamide
CID 33351444
4-[[cyclopropyl-[4-(trifluoromethylsulfonyl)benzoyl]amino]methyl]-N-methylbenzamide
CID 37154016
N-cyclopropyl-5-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2-carboxamide
CID 33351813
N-cyclopropyl-3,4,5-triethoxy-N-[[4-(methylcarbamoyl)phenyl]methyl]benzamide
CID 33351847
4-chloro-N-cyclopropyl-3-iodo-N-[[4-(methylcarbamoyl)phenyl]methyl]benzamide
CID 39881157
4-[[[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]-cyclopropylamino]methyl]-N-methylbenzamide
CID 34181015
N-benzyl-4-(bromomethyl)-N-cyclopropylbenzamide
CID 102850934
N-[4-[[(4-aminocyclohexyl)-benzoylamino]methyl]phenyl]benzamide
CID 23913041
5-bromo-N-cyclopropyl-N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-3-carboxamide
CID 33352211
N-cyclopropyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-4-oxo-3H-phthalazine-1-carboxamide
CID 33351575
4-[[cyclopropyl-(2-naphthalen-2-ylacetyl)amino]methyl]-N-methylbenzamide
CID 33351222
5-bromo-2-chloro-N-cyclopropyl-N-[[4-(methylcarbamoyl)phenyl]methyl]benzamide
CID 33352305

Frequently Asked Questions

What is the IUPAC name of 4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide?
The IUPAC name of 4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide (CID 33351912) is 4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide.
What is the SMILES notation for 4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide?
The canonical SMILES for 4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide is CNC(=O)c1ccc(CN(C(=O)c2ccccc2)C2CC2)cc1.
What is the InChIKey of 4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide?
The InChIKey is MONRTIDATPQJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-20-18(22)15-9-7-14(8-10-15)13-21(17-11-12-17)19(23)16-5-3-2-4-6-16/h2-10,17H,11-13H2,1H3,(H,20,22).
What are the key properties of 4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide?
4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide has a molecular weight of 308.38 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide is sourced from PubChem (CID 33351912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).