N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide

C18H19N3O2 — CID 99801039

IUPACN-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide
SMILESCOc1ccc2cccc(CC(=O)N[C@@H](C)c3ncc[nH]3)c2c1
InChIInChI=1S/C18H19N3O2/c1-12(18-19-8-9-20-18)21-17(22)10-14-5-3-4-13-6-7-15(23-2)11-16(13)14/h3-9,11-12H,10H2,1-2H3,(H,19,20)(H,21,22)/t12-/m0/s1
InChIKeyCUEUEXIDYBKNIG-LBPRGKRZSA-N
MW309.37 g/mol
LogP2.99
Rot. Bonds5

About N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide

N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide (PubChem CID 99801039) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide.

Molecular Properties

Compound NameN-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide
PubChem CID99801039
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide
SMILESCOc1ccc2cccc(CC(=O)N[C@@H](C)c3ncc[nH]3)c2c1
InChIInChI=1S/C18H19N3O2/c1-12(18-19-8-9-20-18)21-17(22)10-14-5-3-4-13-6-7-15(23-2)11-16(13)14/h3-9,11-12H,10H2,1-2H3,(H,19,20)(H,21,22)/t12-/m0/s1
InChIKeyCUEUEXIDYBKNIG-LBPRGKRZSA-N
XLogP2.99
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-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

N-(2-hydroxy-4-methylpentyl)-2-(7-methoxynaphthalen-1-yl)acetamide
CID 109380191
N-[1-(1H-imidazol-2-yl)ethyl]-2-[(7-methoxynaphthalen-2-yl)oxymethyl]-1,3-oxazole-4-carboxamide
CID 56708149
3-(7-methoxynaphthalen-1-yl)-N-(2-methylpropyl)propanamide
CID 19696840
3-cyclopropyl-2-[[2-(7-methoxynaphthalen-1-yl)acetyl]amino]propanoic acid
CID 120535790
2-(7-methoxynaphthalen-1-yl)-N-(4-methyl-3-oxopyrazin-2-yl)acetamide
CID 84589793
2-[[2-(7-methoxynaphthalen-1-yl)acetyl]amino]-2,4-dimethylpentanamide
CID 75388275
N-(2-cyclopentyl-2-hydroxyethyl)-2-(7-methoxynaphthalen-1-yl)acetamide
CID 109380188
N-[2-[[(1R)-1-(2,5-dimethoxyphenyl)ethyl]amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 9477584
N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-(2,4-dimethoxyphenyl)acetamide
CID 18116436
1-(7-methoxynaphthalen-1-yl)-3-methylbut-3-en-2-one
CID 113325070
2-[[2-(7-methoxynaphthalen-1-yl)acetyl]amino]-2-(oxan-3-yl)acetic acid
CID 120548031
2-(7-methoxynaphthalen-1-yl)-N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)propyl]acetamide
CID 75388312

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide?
The IUPAC name of N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide (CID 99801039) is N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide.
What is the SMILES notation for N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide?
The canonical SMILES for N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide is COc1ccc2cccc(CC(=O)N[C@@H](C)c3ncc[nH]3)c2c1.
What is the InChIKey of N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide?
The InChIKey is CUEUEXIDYBKNIG-LBPRGKRZSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-12(18-19-8-9-20-18)21-17(22)10-14-5-3-4-13-6-7-15(23-2)11-16(13)14/h3-9,11-12H,10H2,1-2H3,(H,19,20)(H,21,22)/t12-/m0/s1.
What are the key properties of N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide?
N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide has a molecular weight of 309.37 g/mol, XLogP of 2.99, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(1H-imidazol-2-yl)ethyl]-2-(7-methoxynaphthalen-1-yl)acetamide is sourced from PubChem (CID 99801039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).