4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide

C18H21NO2 — CID 19173284

IUPAC4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide
SMILESCc1ccccc1NC(=O)CCCOc1ccccc1C
InChIInChI=1S/C18H21NO2/c1-14-8-3-5-10-16(14)19-18(20)12-7-13-21-17-11-6-4-9-15(17)2/h3-6,8-11H,7,12-13H2,1-2H3,(H,19,20)
InChIKeyGVVMDXICGHFJNL-UHFFFAOYSA-N
MW283.37 g/mol
LogP4.10
Rot. Bonds6

About 4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide

4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide (PubChem CID 19173284) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide.

Molecular Properties

Compound Name4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide
PubChem CID19173284
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide
SMILESCc1ccccc1NC(=O)CCCOc1ccccc1C
InChIInChI=1S/C18H21NO2/c1-14-8-3-5-10-16(14)19-18(20)12-7-13-21-17-11-6-4-9-15(17)2/h3-6,8-11H,7,12-13H2,1-2H3,(H,19,20)
InChIKeyGVVMDXICGHFJNL-UHFFFAOYSA-N
XLogP4.10
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(5-amino-2-methylphenyl)-4-(2-methylphenoxy)butanamide
CID 16793907
N-(2-methylphenyl)-4-(2-nitrophenoxy)butanamide
CID 84549591
4-(4-fluorophenoxy)-N-(2-methylphenyl)butanamide
CID 86919949
4-(4-ethoxyphenoxy)-N-(2-methylphenyl)butanamide
CID 7946732
4-hydroxy-3-[4-(2-methylphenoxy)butanoylamino]benzoic acid
CID 108753983
N-[2-[4-(2-methylphenoxy)butanoylamino]phenyl]pyridine-3-carboxamide
CID 108925317
4-(2-methylphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide
CID 30887020
N-(2-ethyl-6-methylphenyl)-4-(2-methylphenoxy)butanamide
CID 19173293
4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide
CID 7935064
4-(2,3-dimethylphenoxy)-N-(2-propan-2-ylphenyl)butanamide
CID 19190902
4-(2-methylphenoxy)-N-[2-(morpholin-4-ylmethyl)phenyl]butanamide
CID 55900210
N-(4-methyl-2-nitrophenyl)-4-(2-methylphenoxy)butanamide
CID 19173344

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide?
The IUPAC name of 4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide (CID 19173284) is 4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide.
What is the SMILES notation for 4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide?
The canonical SMILES for 4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide is Cc1ccccc1NC(=O)CCCOc1ccccc1C.
What is the InChIKey of 4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide?
The InChIKey is GVVMDXICGHFJNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-14-8-3-5-10-16(14)19-18(20)12-7-13-21-17-11-6-4-9-15(17)2/h3-6,8-11H,7,12-13H2,1-2H3,(H,19,20).
What are the key properties of 4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide?
4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide has a molecular weight of 283.37 g/mol, XLogP of 4.10, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylphenoxy)-N-(2-methylphenyl)butanamide is sourced from PubChem (CID 19173284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).