2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide

C15H22N2O3 — CID 119684520

IUPAC2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide
SMILESO=C(CNCC1CCCO1)NCCOc1ccccc1
InChIInChI=1S/C15H22N2O3/c18-15(12-16-11-14-7-4-9-19-14)17-8-10-20-13-5-2-1-3-6-13/h1-3,5-6,14,16H,4,7-12H2,(H,17,18)
InChIKeyCEMCNEBCKROMBX-UHFFFAOYSA-N
MW278.35 g/mol
LogP0.95
Rot. Bonds8

About 2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide

2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide (PubChem CID 119684520) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide.

Molecular Properties

Compound Name2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide
PubChem CID119684520
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide
SMILESO=C(CNCC1CCCO1)NCCOc1ccccc1
InChIInChI=1S/C15H22N2O3/c18-15(12-16-11-14-7-4-9-19-14)17-8-10-20-13-5-2-1-3-6-13/h1-3,5-6,14,16H,4,7-12H2,(H,17,18)
InChIKeyCEMCNEBCKROMBX-UHFFFAOYSA-N
XLogP0.95
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(3-methylphenoxy)ethyl]-2-(oxolan-2-ylmethylamino)acetamide
CID 119689704
N-[2-(3-methylphenoxy)ethyl]-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119689703
N-[2-(2-fluorophenoxy)ethyl]-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119681187
2-(cyclopropylmethylamino)-N-(3-phenoxypropyl)acetamide
CID 62380963
N-[2-(oxolan-2-yl)ethyl]-3-phenoxypropanamide
CID 75871156
N-benzyl-2-(oxan-2-ylmethylamino)acetamide
CID 60971571
N-[[(2R)-oxolan-2-yl]methyl]-2-[[(2R)-oxolan-2-yl]methylamino]acetamide
CID 7437120
oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 175652932
1-[2-(4-methylphenoxy)ethyl]-3-(oxolan-2-ylmethyl)urea
CID 47133756
4-[6-(oxolan-2-ylmethylamino)hexoxy]benzoic acid
CID 4829898
2-(ethylamino)-N-(2-phenoxyethyl)acetamide
CID 60672813
N-[4-(oxolan-2-ylmethylamino)phenyl]-3-phenoxypropanamide
CID 112981200

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide?
The IUPAC name of 2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide (CID 119684520) is 2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide.
What is the SMILES notation for 2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide?
The canonical SMILES for 2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide is O=C(CNCC1CCCO1)NCCOc1ccccc1.
What is the InChIKey of 2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide?
The InChIKey is CEMCNEBCKROMBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c18-15(12-16-11-14-7-4-9-19-14)17-8-10-20-13-5-2-1-3-6-13/h1-3,5-6,14,16H,4,7-12H2,(H,17,18).
What are the key properties of 2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide?
2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide has a molecular weight of 278.35 g/mol, XLogP of 0.95, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-ylmethylamino)-N-(2-phenoxyethyl)acetamide is sourced from PubChem (CID 119684520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).