N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide

C20H23N3O2 — CID 30635153

IUPACN-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide
SMILESCc1ccc(CNC(=O)CNc2ccccc2C(=O)NC2CC2)cc1
InChIInChI=1S/C20H23N3O2/c1-14-6-8-15(9-7-14)12-22-19(24)13-21-18-5-3-2-4-17(18)20(25)23-16-10-11-16/h2-9,16,21H,10-13H2,1H3,(H,22,24)(H,23,25)
InChIKeyPOVXKWDLOSZTGA-UHFFFAOYSA-N
MW337.42 g/mol
LogP2.62
Rot. Bonds7

About N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide

N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide (PubChem CID 30635153) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide
PubChem CID30635153
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide
SMILESCc1ccc(CNC(=O)CNc2ccccc2C(=O)NC2CC2)cc1
InChIInChI=1S/C20H23N3O2/c1-14-6-8-15(9-7-14)12-22-19(24)13-21-18-5-3-2-4-17(18)20(25)23-16-10-11-16/h2-9,16,21H,10-13H2,1H3,(H,22,24)(H,23,25)
InChIKeyPOVXKWDLOSZTGA-UHFFFAOYSA-N
XLogP2.62
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-[[2-oxo-2-(propylamino)ethyl]amino]benzamide
CID 32906957
2-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]amino]-N-cyclopropylbenzamide
CID 18144263
2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide
CID 18144272
N-cyclopropyl-2-[[2-oxo-2-(3-phenylpropylamino)ethyl]amino]benzamide
CID 31673829
N-cyclopropyl-2-[[2-(2,5-dimethylanilino)acetyl]amino]benzamide
CID 17498144
N-cyclopropyl-2-[[2-oxo-2-(4-phenylanilino)ethyl]amino]benzamide
CID 24614903
2-(2-bromoanilino)-N-[(4-methylphenyl)methyl]acetamide
CID 33161602
2-[2-[2-(hydroxymethyl)pyrrolidine-1-carbonyl]anilino]-N-[(4-methylphenyl)methyl]acetamide
CID 136524722
N-cyclopropyl-2-[[2-oxo-2-(2-phenoxyanilino)ethyl]amino]benzamide
CID 18144260
N-cyclopropyl-2-[[2-(1,2-dihydroacenaphthylen-5-ylamino)acetyl]amino]benzamide
CID 35812185
N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide
CID 62168218
N-cyclopropyl-2-[[4-(4-methylphenyl)-4-oxobutanoyl]amino]benzamide
CID 34279897

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide?
The IUPAC name of N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide (CID 30635153) is N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide.
What is the SMILES notation for N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide?
The canonical SMILES for N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide is Cc1ccc(CNC(=O)CNc2ccccc2C(=O)NC2CC2)cc1.
What is the InChIKey of N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide?
The InChIKey is POVXKWDLOSZTGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-14-6-8-15(9-7-14)12-22-19(24)13-21-18-5-3-2-4-17(18)20(25)23-16-10-11-16/h2-9,16,21H,10-13H2,1H3,(H,22,24)(H,23,25).
What are the key properties of N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide?
N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide has a molecular weight of 337.42 g/mol, XLogP of 2.62, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]benzamide is sourced from PubChem (CID 30635153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).