2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide

C18H23NO3 — CID 18162432

IUPAC2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide
SMILESCc1cccc(C)c1OCC(=O)NC(C)CCc1ccco1
InChIInChI=1S/C18H23NO3/c1-13-6-4-7-14(2)18(13)22-12-17(20)19-15(3)9-10-16-8-5-11-21-16/h4-8,11,15H,9-10,12H2,1-3H3,(H,19,20)
InChIKeyWTCPBDLKAIPELT-UHFFFAOYSA-N
MW301.39 g/mol
LogP3.41
Rot. Bonds7

About 2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide

2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide (PubChem CID 18162432) has the molecular formula C18H23NO3 and a molecular weight of 301.39 g/mol. Its IUPAC name is 2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide.

Molecular Properties

Compound Name2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide
PubChem CID18162432
Molecular FormulaC18H23NO3
Molecular Weight301.39 g/mol
Exact Mass301.17
IUPAC Name2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide
SMILESCc1cccc(C)c1OCC(=O)NC(C)CCc1ccco1
InChIInChI=1S/C18H23NO3/c1-13-6-4-7-14(2)18(13)22-12-17(20)19-15(3)9-10-16-8-5-11-21-16/h4-8,11,15H,9-10,12H2,1-3H3,(H,19,20)
InChIKeyWTCPBDLKAIPELT-UHFFFAOYSA-N
XLogP3.41
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-chloro-5-methylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide
CID 18162414
N-[4-(furan-2-yl)butan-2-yl]-3-oxobutanamide
CID 61251024
N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide
CID 61249906
N-[(2R)-4-(furan-2-yl)butan-2-yl]-3-methylbutanamide
CID 94153264
N-[1-(furan-2-yl)propan-2-yl]-2-(2-methylphenoxy)acetamide
CID 47168840
2-[4-(furan-2-yl)butan-2-ylamino]oxyacetamide
CID 112673041
ethyl N-[4-(furan-2-yl)butan-2-yl]carbamate
CID 60651451
2-(2,6-dimethylphenoxy)-N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]acetamide
CID 46470415
5-amino-N-[4-(furan-2-yl)butan-2-yl]-4-methylpentanamide
CID 82012267
4-[2-(ethylamino)-2-oxoethoxy]-N-[4-(furan-2-yl)butan-2-yl]benzamide
CID 42944232
N-[4-(furan-2-yl)butan-2-yl]-4-(propan-2-ylamino)butanamide
CID 61249924
N-[1-(furan-2-yl)propan-2-yl]-2-phenoxyacetamide
CID 47148392

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide?
The IUPAC name of 2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide (CID 18162432) is 2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide.
What is the SMILES notation for 2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide?
The canonical SMILES for 2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide is Cc1cccc(C)c1OCC(=O)NC(C)CCc1ccco1.
What is the InChIKey of 2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide?
The InChIKey is WTCPBDLKAIPELT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO3/c1-13-6-4-7-14(2)18(13)22-12-17(20)19-15(3)9-10-16-8-5-11-21-16/h4-8,11,15H,9-10,12H2,1-3H3,(H,19,20).
What are the key properties of 2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide?
2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide has a molecular weight of 301.39 g/mol, XLogP of 3.41, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylphenoxy)-N-[4-(furan-2-yl)butan-2-yl]acetamide is sourced from PubChem (CID 18162432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).