2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide

C16H24N2O3 — CID 60997144

IUPAC2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide
SMILESCCOc1ccc(C(C)(NCC2CCCO2)C(N)=O)cc1
InChIInChI=1S/C16H24N2O3/c1-3-20-13-8-6-12(7-9-13)16(2,15(17)19)18-11-14-5-4-10-21-14/h6-9,14,18H,3-5,10-11H2,1-2H3,(H2,17,19)
InChIKeyRNKSUFHDPJKISI-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.55
Rot. Bonds7

About 2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide

2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide (PubChem CID 60997144) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide
PubChem CID60997144
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide
SMILESCCOc1ccc(C(C)(NCC2CCCO2)C(N)=O)cc1
InChIInChI=1S/C16H24N2O3/c1-3-20-13-8-6-12(7-9-13)16(2,15(17)19)18-11-14-5-4-10-21-14/h6-9,14,18H,3-5,10-11H2,1-2H3,(H2,17,19)
InChIKeyRNKSUFHDPJKISI-UHFFFAOYSA-N
XLogP1.55
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-ethylphenyl)-2-(oxolan-2-ylmethylamino)propanamide
CID 60996868
4-ethoxy-N-(oxolan-2-ylmethyl)benzamide
CID 2850672
2-(cyclopentylamino)-2-(4-ethoxyphenyl)propanamide
CID 60999099
2-(4-ethoxyanilino)-N-(oxolan-2-ylmethyl)acetamide
CID 54811659
[2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] 2-[(4-ethoxybenzoyl)amino]acetate
CID 7884918
ethyl 2-(2-chlorophenyl)-2-(oxolan-2-ylmethylamino)propanoate
CID 60993340
ethyl 2-(3-bromophenyl)-2-(oxolan-2-ylmethylamino)propanoate
CID 60993481
2-[2-(dimethylamino)ethylamino]-2-(4-ethoxyphenyl)propanamide
CID 60991163
ethyl 2-(2-bromophenyl)-2-(oxolan-2-ylmethylamino)propanoate
CID 60993773
4-[[2-(4-ethoxyanilino)acetyl]amino]-N-(oxolan-2-ylmethyl)benzamide
CID 54811294
1-(4-ethoxyphenyl)-2-(oxolan-2-ylmethoxy)ethanone
CID 43798299
4-[(4-tert-butylphenoxy)methyl]-N-(oxolan-2-ylmethyl)benzamide
CID 6914711

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide?
The IUPAC name of 2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide (CID 60997144) is 2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide.
What is the SMILES notation for 2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide?
The canonical SMILES for 2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide is CCOc1ccc(C(C)(NCC2CCCO2)C(N)=O)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide?
The InChIKey is RNKSUFHDPJKISI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-3-20-13-8-6-12(7-9-13)16(2,15(17)19)18-11-14-5-4-10-21-14/h6-9,14,18H,3-5,10-11H2,1-2H3,(H2,17,19).
What are the key properties of 2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide?
2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide has a molecular weight of 292.38 g/mol, XLogP of 1.55, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)propanamide is sourced from PubChem (CID 60997144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).