4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide

C19H23N3O2 — CID 108540008

IUPAC4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide
SMILESCN(C)c1ccc(C(=O)NCCNC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C19H23N3O2/c1-22(2)17-10-8-16(9-11-17)19(24)21-13-12-20-18(23)14-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyKWHPIIWHBSUXLF-UHFFFAOYSA-N
MW325.41 g/mol
LogP1.84
Rot. Bonds7

About 4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide

4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide (PubChem CID 108540008) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide
PubChem CID108540008
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide
SMILESCN(C)c1ccc(C(=O)NCCNC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C19H23N3O2/c1-22(2)17-10-8-16(9-11-17)19(24)21-13-12-20-18(23)14-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyKWHPIIWHBSUXLF-UHFFFAOYSA-N
XLogP1.84
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-benzamidoethyl)-4-(dimethylamino)benzamide
CID 38175898
4-(dimethylamino)-N-(3-phenylpropyl)benzamide
CID 27647106
4-(dimethylamino)-N-[2-[(2-methoxyacetyl)amino]ethyl]benzamide
CID 108542960
N-[2-[(2-phenylacetyl)amino]ethyl]-4-propan-2-ylbenzamide
CID 108571670
4-tert-butyl-N-[2-[[4-(dimethylamino)benzoyl]amino]ethyl]benzamide
CID 108542009
N-[2-(4-chlorobutanoylamino)ethyl]-4-(dimethylamino)benzamide
CID 108574903
N-[2-[3-[4-(dimethylamino)phenyl]propylamino]-2-oxoethyl]benzamide
CID 46424122
N-[2-[[4-(dimethylamino)benzoyl]amino]ethyl]-3,5-dihydroxybenzamide
CID 108543039
4-[[4-(dimethylamino)benzoyl]amino]butanoic acid
CID 10658325
4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide
CID 110473275
N-[4-(dimethylamino)phenyl]-2-phenylacetamide
CID 4095589
4-(dimethylamino)-N-(3-phenylsulfanylpropyl)benzamide
CID 24686106

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide?
The IUPAC name of 4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide (CID 108540008) is 4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide?
The canonical SMILES for 4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide is CN(C)c1ccc(C(=O)NCCNC(=O)Cc2ccccc2)cc1.
What is the InChIKey of 4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide?
The InChIKey is KWHPIIWHBSUXLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-22(2)17-10-8-16(9-11-17)19(24)21-13-12-20-18(23)14-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3,(H,20,23)(H,21,24).
What are the key properties of 4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide?
4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide has a molecular weight of 325.41 g/mol, XLogP of 1.84, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide is sourced from PubChem (CID 108540008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).