N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide

C18H23N3O — CID 113032651

IUPACN-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide
SMILESCCc1cccc(C)c1Nc1ccc(NC(=O)C(C)C)nc1
InChIInChI=1S/C18H23N3O/c1-5-14-8-6-7-13(4)17(14)20-15-9-10-16(19-11-15)21-18(22)12(2)3/h6-12,20H,5H2,1-4H3,(H,19,21,22)
InChIKeyYBVFLSSEHIMMCO-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.29
Rot. Bonds5

About N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide

N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide (PubChem CID 113032651) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide
PubChem CID113032651
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC NameN-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide
SMILESCCc1cccc(C)c1Nc1ccc(NC(=O)C(C)C)nc1
InChIInChI=1S/C18H23N3O/c1-5-14-8-6-7-13(4)17(14)20-15-9-10-16(19-11-15)21-18(22)12(2)3/h6-12,20H,5H2,1-4H3,(H,19,21,22)
InChIKeyYBVFLSSEHIMMCO-UHFFFAOYSA-N
XLogP4.29
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]carbamate
CID 113032674
2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide
CID 113026479
N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-3,5-dimethoxybenzamide
CID 113032663
1-[6-(2-ethyl-6-methylanilino)-3-pyridinyl]-3-phenylurea
CID 113017689
N-[6-(2-ethyl-6-methylanilino)-3-pyridinyl]benzamide
CID 113017656
N-(4-acetamidophenyl)-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide
CID 109198611
N-[5-(2-methyl-6-propan-2-ylanilino)-2-pyridinyl]butanamide
CID 113032871
N-[6-(2-ethyl-6-methylanilino)-3-pyridinyl]-4-methylbenzamide
CID 113017659
ethyl N-[5-(2-methyl-6-propan-2-ylanilino)-2-pyridinyl]carbamate
CID 113032879
N-[5-(2,6-dimethylanilino)-2-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113032265
N-[6-(2-ethyl-6-methylanilino)-3-pyridinyl]cyclobutanecarboxamide
CID 113017694
N-[5-(4-fluoroanilino)-2-pyridinyl]-2-methylpropanamide
CID 113033078

Frequently Asked Questions

What is the IUPAC name of N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide?
The IUPAC name of N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide (CID 113032651) is N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide.
What is the SMILES notation for N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide?
The canonical SMILES for N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide is CCc1cccc(C)c1Nc1ccc(NC(=O)C(C)C)nc1.
What is the InChIKey of N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide?
The InChIKey is YBVFLSSEHIMMCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O/c1-5-14-8-6-7-13(4)17(14)20-15-9-10-16(19-11-15)21-18(22)12(2)3/h6-12,20H,5H2,1-4H3,(H,19,21,22).
What are the key properties of N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide?
N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide has a molecular weight of 297.40 g/mol, XLogP of 4.29, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide is sourced from PubChem (CID 113032651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).