N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide

C17H28N2O2 — CID 111336392

IUPACN-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide
SMILESCCc1ccc(C(C)NC(=O)CN(C)CC(C)(C)O)cc1
InChIInChI=1S/C17H28N2O2/c1-6-14-7-9-15(10-8-14)13(2)18-16(20)11-19(5)12-17(3,4)21/h7-10,13,21H,6,11-12H2,1-5H3,(H,18,20)
InChIKeyBFYUHIUDVALRIQ-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.13
Rot. Bonds7

About N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide

N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide (PubChem CID 111336392) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide.

Molecular Properties

Compound NameN-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide
PubChem CID111336392
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC NameN-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide
SMILESCCc1ccc(C(C)NC(=O)CN(C)CC(C)(C)O)cc1
InChIInChI=1S/C17H28N2O2/c1-6-14-7-9-15(10-8-14)13(2)18-16(20)11-19(5)12-17(3,4)21/h7-10,13,21H,6,11-12H2,1-5H3,(H,18,20)
InChIKeyBFYUHIUDVALRIQ-UHFFFAOYSA-N
XLogP2.13
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]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-(diethylamino)-2-oxoethyl]-methylamino]-N-[1-(4-ethylphenyl)ethyl]acetamide
CID 51226406
2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide
CID 27107976
N-(2,6-dimethylphenyl)-2-[[2-[[(1R)-1-(4-ethylphenyl)ethyl]amino]-2-oxoethyl]-methylamino]acetamide
CID 9221920
2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide
CID 18291170
N-[1-(4-ethylphenyl)ethyl]-3-oxobutanamide
CID 54896208
3-[1-(4-ethylphenyl)ethylamino]-3-oxopropanoic acid
CID 55049684
1-tert-butyl-3-[1-(4-ethylphenyl)ethyl]urea
CID 108896878
2-(4-ethyl-N-methylsulfonylanilino)-N-[(1S)-1-(4-ethylphenyl)ethyl]acetamide
CID 100701915
N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide
CID 17326867
N-[(1R)-1-(4-ethylphenyl)ethyl]-2-[methyl-(4-methylsulfanylphenyl)sulfonylamino]acetamide
CID 100503817
N-[1-(4-ethylphenyl)ethyl]-2-phenylacetamide
CID 2854113
2-[methyl-[2-[1-[4-(2-methylpropyl)phenyl]ethylamino]-2-oxoethyl]amino]acetamide
CID 56814568

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide?
The IUPAC name of N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide (CID 111336392) is N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide.
What is the SMILES notation for N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide?
The canonical SMILES for N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide is CCc1ccc(C(C)NC(=O)CN(C)CC(C)(C)O)cc1.
What is the InChIKey of N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide?
The InChIKey is BFYUHIUDVALRIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-6-14-7-9-15(10-8-14)13(2)18-16(20)11-19(5)12-17(3,4)21/h7-10,13,21H,6,11-12H2,1-5H3,(H,18,20).
What are the key properties of N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide?
N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide has a molecular weight of 292.42 g/mol, XLogP of 2.13, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide is sourced from PubChem (CID 111336392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).