N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide

C26H26N4O — CID 177349338

IUPACN-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide
SMILESCCc1ccc(-c2ccc(CC(=O)NCc3ccc(-c4cnc(N)[nH]4)cc3)cc2)cc1
InChIInChI=1S/C26H26N4O/c1-2-18-3-9-21(10-4-18)22-11-5-19(6-12-22)15-25(31)28-16-20-7-13-23(14-8-20)24-17-29-26(27)30-24/h3-14,17H,2,15-16H2,1H3,(H,28,31)(H3,27,29,30)
InChIKeyLPVUXRPKYBVWKY-UHFFFAOYSA-N
MW410.52 g/mol
LogP4.75
Rot. Bonds7

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

N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide (PubChem CID 177349338) has the molecular formula C26H26N4O and a molecular weight of 410.52 g/mol. Its IUPAC name is N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide
PubChem CID177349338
Molecular FormulaC26H26N4O
Molecular Weight410.52 g/mol
Exact Mass410.21
IUPAC NameN-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide
SMILESCCc1ccc(-c2ccc(CC(=O)NCc3ccc(-c4cnc(N)[nH]4)cc3)cc2)cc1
InChIInChI=1S/C26H26N4O/c1-2-18-3-9-21(10-4-18)22-11-5-19(6-12-22)15-25(31)28-16-20-7-13-23(14-8-20)24-17-29-26(27)30-24/h3-14,17H,2,15-16H2,1H3,(H,28,31)(H3,27,29,30)
InChIKeyLPVUXRPKYBVWKY-UHFFFAOYSA-N
XLogP4.75
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.52
LogP ≤ 54.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]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

N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(3,5-dimethylphenyl)phenyl]acetamide;thiohydroxylamine
CID 177349139
N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(oxan-4-yl)phenyl]acetamide;thiohydroxylamine
CID 177349308
N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[6-(4-chlorophenyl)-3-pyridinyl]acetamide;thiohydroxylamine
CID 177349019
N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-(3-phenyl-2,3-dihydro-1H-indol-5-yl)acetamide
CID 177349013
N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[6-(piperidin-4-ylsulfonylamino)-3-pyridinyl]acetamide
CID 177349144
2-amino-3-[5-(4-ethylphenyl)-1H-imidazol-2-yl]propanoic acid
CID 116881749
N-[4-(2-amino-1H-imidazol-5-yl)phenyl]-4-pentylbenzamide
CID 46890697
2-[4-(2-amino-1H-imidazol-5-yl)phenyl]-1-(3,4-dichlorophenyl)ethanone
CID 158314865
2-amino-2-[5-(4-ethylphenyl)-1H-imidazol-2-yl]acetic acid
CID 116881459
N-[(4-ethylphenyl)methyl]butanamide
CID 110779517
4-(2-amino-1H-imidazol-5-yl)benzoic acid;hydrochloride
CID 69483664
N-[[4-(2-amino-1H-imidazol-5-yl)-3-methoxyphenyl]methyl]-2-[4-(phenylsulfanylamino)phenyl]acetamide
CID 177349110

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide?
The IUPAC name of N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide (CID 177349338) is N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide.
What is the SMILES notation for N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide?
The canonical SMILES for N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide is CCc1ccc(-c2ccc(CC(=O)NCc3ccc(-c4cnc(N)[nH]4)cc3)cc2)cc1.
What is the InChIKey of N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide?
The InChIKey is LPVUXRPKYBVWKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N4O/c1-2-18-3-9-21(10-4-18)22-11-5-19(6-12-22)15-25(31)28-16-20-7-13-23(14-8-20)24-17-29-26(27)30-24/h3-14,17H,2,15-16H2,1H3,(H,28,31)(H3,27,29,30).
What are the key properties of N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide?
N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide has a molecular weight of 410.52 g/mol, XLogP of 4.75, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-amino-1H-imidazol-5-yl)phenyl]methyl]-2-[4-(4-ethylphenyl)phenyl]acetamide is sourced from PubChem (CID 177349338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).