N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide

C18H17N3O2 — CID 110668475

IUPACN-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)Nc1ccc(-c2cnc[nH]2)cc1
InChIInChI=1S/C18H17N3O2/c1-13-4-2-3-5-17(13)23-11-18(22)21-15-8-6-14(7-9-15)16-10-19-12-20-16/h2-10,12H,11H2,1H3,(H,19,20)(H,21,22)
InChIKeyKTYGFBPNXQCRKF-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.40
Rot. Bonds5

About N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide

N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide (PubChem CID 110668475) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide
PubChem CID110668475
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC NameN-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)Nc1ccc(-c2cnc[nH]2)cc1
InChIInChI=1S/C18H17N3O2/c1-13-4-2-3-5-17(13)23-11-18(22)21-15-8-6-14(7-9-15)16-10-19-12-20-16/h2-10,12H,11H2,1H3,(H,19,20)(H,21,22)
InChIKeyKTYGFBPNXQCRKF-UHFFFAOYSA-N
XLogP3.40
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)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-methylphenoxy)-N-pyridin-4-ylacetamide
CID 1101312
2-(2-methylphenoxy)-N-[4-(5-methyl-1H-pyrazol-3-yl)phenyl]acetamide
CID 110732601
N-(4-hydroxyphenyl)-2-(2-methylphenoxy)acetamide
CID 38113216
2-(2-methylphenoxy)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide
CID 108748059
N-[4-(1H-benzimidazol-2-yl)phenyl]-2-(2-methylphenoxy)acetamide
CID 1369927
N-[4-(dimethylamino)phenyl]-2-(2-methylphenoxy)acetamide
CID 2443872
N-[4-(2-methoxyethoxy)phenyl]-2-(2-methylphenoxy)acetamide
CID 17340393
2-chloro-N-[4-[[2-(2-methylphenoxy)acetyl]amino]phenyl]benzamide
CID 35767797
4-[4-(1H-imidazol-5-yl)anilino]-2,2-dimethyl-4-oxobutanoic acid
CID 65302307
2-(2-methylphenoxy)-N-(3-methylphenyl)acetamide
CID 747103
2-(2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 675575
N-[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-(2-methylphenoxy)acetamide
CID 1361277

Frequently Asked Questions

What is the IUPAC name of N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide (CID 110668475) is N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide is Cc1ccccc1OCC(=O)Nc1ccc(-c2cnc[nH]2)cc1.
What is the InChIKey of N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide?
The InChIKey is KTYGFBPNXQCRKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-13-4-2-3-5-17(13)23-11-18(22)21-15-8-6-14(7-9-15)16-10-19-12-20-16/h2-10,12H,11H2,1H3,(H,19,20)(H,21,22).
What are the key properties of N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide?
N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide has a molecular weight of 307.35 g/mol, XLogP of 3.40, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1H-imidazol-5-yl)phenyl]-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 110668475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).