2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide

C17H24N2O3 — CID 113163958

IUPAC2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide
SMILESCC(=O)N(CCc1ccccc1)CC(=O)NCC1CCCO1
InChIInChI=1S/C17H24N2O3/c1-14(20)19(10-9-15-6-3-2-4-7-15)13-17(21)18-12-16-8-5-11-22-16/h2-4,6-7,16H,5,8-13H2,1H3,(H,18,21)
InChIKeySMIGPJYIHNAIDC-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.37
Rot. Bonds7

About 2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide

2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide (PubChem CID 113163958) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide
PubChem CID113163958
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide
SMILESCC(=O)N(CCc1ccccc1)CC(=O)NCC1CCCO1
InChIInChI=1S/C17H24N2O3/c1-14(20)19(10-9-15-6-3-2-4-7-15)13-17(21)18-12-16-8-5-11-22-16/h2-4,6-7,16H,5,8-13H2,1H3,(H,18,21)
InChIKeySMIGPJYIHNAIDC-UHFFFAOYSA-N
XLogP1.37
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)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-[acetyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]-N-(oxolan-2-ylmethyl)acetamide
CID 113165315
2-[methylsulfonyl(2-phenylethyl)amino]-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 963775
2-[(4-methylphenyl)sulfonyl-(2-phenylethyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 1119935
2-(N-acetyl-2-methylanilino)-N-(oxolan-2-ylmethyl)acetamide
CID 113167272
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(oxolan-2-ylmethyl)acetamide
CID 113165954
N'-[[(2S)-oxolan-2-yl]methyl]-N-(2-phenylethyl)butanediamide
CID 7303399
1-benzyl-3-[[(2S)-oxolan-2-yl]methyl]-1-(2-phenylethyl)thiourea
CID 7027975
2-[benzyl(methyl)amino]-N-[[(2R)-oxan-2-yl]methyl]acetamide
CID 94216554
3-[acetyl(oxolan-2-ylmethyl)amino]-N-(3-phenylpropyl)propanamide
CID 113117320
3-[acetyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]-N-(oxolan-2-ylmethyl)propanamide
CID 113121874
2-(N-acetyl-2-ethylanilino)-N-(oxolan-2-ylmethyl)acetamide
CID 113169027
2-[acetyl-[(3,4-dimethoxyphenyl)methyl]amino]-N-(oxolan-2-ylmethyl)acetamide
CID 113165554

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide?
The IUPAC name of 2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide (CID 113163958) is 2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide?
The canonical SMILES for 2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide is CC(=O)N(CCc1ccccc1)CC(=O)NCC1CCCO1.
What is the InChIKey of 2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide?
The InChIKey is SMIGPJYIHNAIDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-14(20)19(10-9-15-6-3-2-4-7-15)13-17(21)18-12-16-8-5-11-22-16/h2-4,6-7,16H,5,8-13H2,1H3,(H,18,21).
What are the key properties of 2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide?
2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide has a molecular weight of 304.39 g/mol, XLogP of 1.37, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(2-phenylethyl)amino]-N-(oxolan-2-ylmethyl)acetamide is sourced from PubChem (CID 113163958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).