N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide

C21H21N3O — CID 113016495

IUPACN-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
SMILESCc1cccc(CC(=O)Nc2ccc(N(C)c3ccccc3)nc2)c1
InChIInChI=1S/C21H21N3O/c1-16-7-6-8-17(13-16)14-21(25)23-18-11-12-20(22-15-18)24(2)19-9-4-3-5-10-19/h3-13,15H,14H2,1-2H3,(H,23,25)
InChIKeyRHDYIERLQGLOEO-UHFFFAOYSA-N
MW331.42 g/mol
LogP4.34
Rot. Bonds5

About N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide

N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide (PubChem CID 113016495) has the molecular formula C21H21N3O and a molecular weight of 331.42 g/mol. Its IUPAC name is N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
PubChem CID113016495
Molecular FormulaC21H21N3O
Molecular Weight331.42 g/mol
Exact Mass331.17
IUPAC NameN-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
SMILESCc1cccc(CC(=O)Nc2ccc(N(C)c3ccccc3)nc2)c1
InChIInChI=1S/C21H21N3O/c1-16-7-6-8-17(13-16)14-21(25)23-18-11-12-20(22-15-18)24(2)19-9-4-3-5-10-19/h3-13,15H,14H2,1-2H3,(H,23,25)
InChIKeyRHDYIERLQGLOEO-UHFFFAOYSA-N
XLogP4.34
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromophenyl)-N-[6-(N-methylanilino)-3-pyridinyl]acetamide
CID 113016501
N-[6-[benzyl(propan-2-yl)amino]-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113015034
N-[6-[(1,1-dioxothiolan-3-yl)-methylamino]-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113013706
2-(3-methylphenyl)-N-phenylacetamide
CID 6470005
2-(3-methylphenyl)-N-(4-phenylmethoxyphenyl)acetamide
CID 113098761
tert-butyl N-[6-(N-methylanilino)-3-pyridinyl]carbamate
CID 113016500
N-[4-[[2-(dimethylamino)acetyl]amino]phenyl]-2-(3-methylphenyl)acetamide
CID 71985828
6-(N-methylanilino)-N-[2-[(3-methylphenyl)methyl]pyrazol-3-yl]pyridine-3-carboxamide
CID 112830892
N-[6-(4-methoxyanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113019533
2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide
CID 113023476
N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113017495
N-[2-(2-fluorophenoxy)pyrimidin-5-yl]-2-(3-methylphenyl)acetamide
CID 122302992

Frequently Asked Questions

What is the IUPAC name of N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide?
The IUPAC name of N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide (CID 113016495) is N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide is Cc1cccc(CC(=O)Nc2ccc(N(C)c3ccccc3)nc2)c1.
What is the InChIKey of N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide?
The InChIKey is RHDYIERLQGLOEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O/c1-16-7-6-8-17(13-16)14-21(25)23-18-11-12-20(22-15-18)24(2)19-9-4-3-5-10-19/h3-13,15H,14H2,1-2H3,(H,23,25).
What are the key properties of N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide?
N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide has a molecular weight of 331.42 g/mol, XLogP of 4.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(N-methylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 113016495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).