N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide

C20H21N3O — CID 57347427

IUPACN-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide
SMILESCc1ccc(Nc2ccccc2NC(=O)CN2C=CC=CC2)cc1
InChIInChI=1S/C20H21N3O/c1-16-9-11-17(12-10-16)21-18-7-3-4-8-19(18)22-20(24)15-23-13-5-2-6-14-23/h2-13,21H,14-15H2,1H3,(H,22,24)
InChIKeyIAYNMHFHLXWUFQ-UHFFFAOYSA-N
MW319.41 g/mol
LogP4.06
Rot. Bonds5

About N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide

N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide (PubChem CID 57347427) has the molecular formula C20H21N3O and a molecular weight of 319.41 g/mol. Its IUPAC name is N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide
PubChem CID57347427
Molecular FormulaC20H21N3O
Molecular Weight319.41 g/mol
Exact Mass319.17
IUPAC NameN-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide
SMILESCc1ccc(Nc2ccccc2NC(=O)CN2C=CC=CC2)cc1
InChIInChI=1S/C20H21N3O/c1-16-9-11-17(12-10-16)21-18-7-3-4-8-19(18)22-20(24)15-23-13-5-2-6-14-23/h2-13,21H,14-15H2,1H3,(H,22,24)
InChIKeyIAYNMHFHLXWUFQ-UHFFFAOYSA-N
XLogP4.06
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,3-dioxoisoindol-2-yl)-N-[2-(4-methylanilino)phenyl]acetamide
CID 108767299
2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-[2-(4-methylanilino)phenyl]acetamide
CID 108806604
N-[2-(4-methylanilino)phenyl]acetamide
CID 21106134
2-(4-fluorophenyl)-N-[2-(4-methylanilino)phenyl]acetamide
CID 108767260
N-[2-(4-methylanilino)phenyl]-5-oxo-5-phenylpentanamide
CID 108745056
4-chloro-N-[2-(4-methylanilino)phenyl]benzamide
CID 108767264
N-[2-(4-methylanilino)phenyl]-2-(2,3,6-trimethylphenoxy)acetamide
CID 108767365
4-[(4,6-dimethylpyrimidin-2-yl)amino]-N-[2-(4-methylanilino)phenyl]butanamide
CID 108800818
2-(3,4-dimethylphenoxy)-N-[2-(4-methylanilino)phenyl]acetamide
CID 108767360
N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide
CID 108745039
N-[2-(4-methoxyanilino)phenyl]-2-[(4R)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 40942598
prop-2-enyl N-[2-(4-methylanilino)phenyl]carbamate
CID 108745022

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide?
The IUPAC name of N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide (CID 57347427) is N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide.
What is the SMILES notation for N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide?
The canonical SMILES for N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide is Cc1ccc(Nc2ccccc2NC(=O)CN2C=CC=CC2)cc1.
What is the InChIKey of N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide?
The InChIKey is IAYNMHFHLXWUFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O/c1-16-9-11-17(12-10-16)21-18-7-3-4-8-19(18)22-20(24)15-23-13-5-2-6-14-23/h2-13,21H,14-15H2,1H3,(H,22,24).
What are the key properties of N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide?
N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide has a molecular weight of 319.41 g/mol, XLogP of 4.06, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylanilino)phenyl]-2-(2H-pyridin-1-yl)acetamide is sourced from PubChem (CID 57347427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).