N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide

C19H23N3O3 — CID 54817318

IUPACN-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide
SMILESCOc1ccccc1NCC(=O)Nc1cccc(NC(=O)C(C)C)c1
InChIInChI=1S/C19H23N3O3/c1-13(2)19(24)22-15-8-6-7-14(11-15)21-18(23)12-20-16-9-4-5-10-17(16)25-3/h4-11,13,20H,12H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyZBCRGIXTFGVFBN-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.34
Rot. Bonds7

About N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide

N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide (PubChem CID 54817318) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide
PubChem CID54817318
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide
SMILESCOc1ccccc1NCC(=O)Nc1cccc(NC(=O)C(C)C)c1
InChIInChI=1S/C19H23N3O3/c1-13(2)19(24)22-15-8-6-7-14(11-15)21-18(23)12-20-16-9-4-5-10-17(16)25-3/h4-11,13,20H,12H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyZBCRGIXTFGVFBN-UHFFFAOYSA-N
XLogP3.34
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[[2-(2-ethoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54817227
N-[3-[[2-(2-chloroanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54810373
2-(2-methoxyanilino)-N-phenylacetamide
CID 7636827
2-methyl-N-[3-[[2-[2-(2-methylpropoxy)anilino]-2-oxoethyl]amino]phenyl]propanamide
CID 54831517
N-[4-[[2-(2,5-dimethoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54814052
N-[4-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-3-methylbutanamide
CID 54817342
N-[3-[[2-(3,5-dimethylanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54813263
N-(3,4-dichlorophenyl)-2-(2-methoxyanilino)acetamide
CID 9080426
N-[3-[[2-(4-acetamidoanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54809331
N-[3-[[2-(3-chloroanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54809062
2-(2,5-dimethoxyanilino)-N-(3-propan-2-yloxyphenyl)acetamide
CID 54813924
N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide
CID 9080460

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide?
The IUPAC name of N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide (CID 54817318) is N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide.
What is the SMILES notation for N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide?
The canonical SMILES for N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide is COc1ccccc1NCC(=O)Nc1cccc(NC(=O)C(C)C)c1.
What is the InChIKey of N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide?
The InChIKey is ZBCRGIXTFGVFBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-13(2)19(24)22-15-8-6-7-14(11-15)21-18(23)12-20-16-9-4-5-10-17(16)25-3/h4-11,13,20H,12H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide?
N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide has a molecular weight of 341.41 g/mol, XLogP of 3.34, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-(2-methoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide is sourced from PubChem (CID 54817318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).