N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide

C19H21F2N3O2 — CID 55863997

IUPACN-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide
SMILESCc1ccc(C)c(N(C)CC(=O)NCC(=O)Nc2ccc(F)c(F)c2)c1
InChIInChI=1S/C19H21F2N3O2/c1-12-4-5-13(2)17(8-12)24(3)11-19(26)22-10-18(25)23-14-6-7-15(20)16(21)9-14/h4-9H,10-11H2,1-3H3,(H,22,26)(H,23,25)
InChIKeyCLSZPPDMATZCNX-UHFFFAOYSA-N
MW361.39 g/mol
LogP2.77
Rot. Bonds6

About N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide

N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide (PubChem CID 55863997) has the molecular formula C19H21F2N3O2 and a molecular weight of 361.39 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide
PubChem CID55863997
Molecular FormulaC19H21F2N3O2
Molecular Weight361.39 g/mol
Exact Mass361.16
IUPAC NameN-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide
SMILESCc1ccc(C)c(N(C)CC(=O)NCC(=O)Nc2ccc(F)c(F)c2)c1
InChIInChI=1S/C19H21F2N3O2/c1-12-4-5-13(2)17(8-12)24(3)11-19(26)22-10-18(25)23-14-6-7-15(20)16(21)9-14/h4-9H,10-11H2,1-3H3,(H,22,26)(H,23,25)
InChIKeyCLSZPPDMATZCNX-UHFFFAOYSA-N
XLogP2.77
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.39
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-difluorophenyl)-2-[[2-[(2,4-dimethylphenyl)methyl-methylamino]acetyl]amino]acetamide
CID 8695732
N-(3,4-difluorophenyl)-2-[[2-(2-methyl-N-methylsulfonylanilino)acetyl]amino]acetamide
CID 30857477
2-[[2-[cyclohexyl(methyl)amino]acetyl]amino]-N-(3,4-difluorophenyl)acetamide
CID 18087279
N-[(2-fluorophenyl)methyl]-2-(N,2,5-trimethylanilino)acetamide
CID 60525035
2-[[2-(3,4-difluoroanilino)-2-oxoethyl]-methylamino]-N-(4-methylphenyl)acetamide
CID 8729092
N-(3,4-difluorophenyl)-4-(2,5-dimethyl-N-methylsulfonylanilino)butanamide
CID 21367184
N-(3,4-difluorophenyl)-2-[[2-(4-methylphenyl)sulfanylacetyl]amino]acetamide
CID 27772603
N-(3,4-difluorophenyl)-2-[[2-[(3,4-dimethoxyphenyl)methyl-methylamino]acetyl]amino]acetamide
CID 8845299
2-[(3,4-difluorophenyl)carbamoylamino]-N-(3-methylphenyl)acetamide
CID 42663674
methyl N-[2-(3,4-difluoroanilino)-2-oxoethyl]carbamate
CID 47129041
2-(N-acetyl-2,5-dimethylanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 113168163
N-(4-pyrrolidin-1-ylphenyl)-2-(N,2,5-trimethylanilino)acetamide
CID 52689165

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide?
The IUPAC name of N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide (CID 55863997) is N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide?
The canonical SMILES for N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide is Cc1ccc(C)c(N(C)CC(=O)NCC(=O)Nc2ccc(F)c(F)c2)c1.
What is the InChIKey of N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide?
The InChIKey is CLSZPPDMATZCNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F2N3O2/c1-12-4-5-13(2)17(8-12)24(3)11-19(26)22-10-18(25)23-14-6-7-15(20)16(21)9-14/h4-9H,10-11H2,1-3H3,(H,22,26)(H,23,25).
What are the key properties of N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide?
N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide has a molecular weight of 361.39 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-2-[[2-(N,2,5-trimethylanilino)acetyl]amino]acetamide is sourced from PubChem (CID 55863997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).