N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide

C17H26N2O2 — CID 51097037

IUPACN-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide
SMILESCCN(CC1CCOC1)C(=O)CN(CC)c1ccccc1
InChIInChI=1S/C17H26N2O2/c1-3-18(16-8-6-5-7-9-16)13-17(20)19(4-2)12-15-10-11-21-14-15/h5-9,15H,3-4,10-14H2,1-2H3
InChIKeyZPDRNKSALUFFMH-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.40
Rot. Bonds7

About N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide

N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide (PubChem CID 51097037) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide
PubChem CID51097037
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide
SMILESCCN(CC1CCOC1)C(=O)CN(CC)c1ccccc1
InChIInChI=1S/C17H26N2O2/c1-3-18(16-8-6-5-7-9-16)13-17(20)19(4-2)12-15-10-11-21-14-15/h5-9,15H,3-4,10-14H2,1-2H3
InChIKeyZPDRNKSALUFFMH-UHFFFAOYSA-N
XLogP2.40
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-ethyl-N-(oxolan-3-ylmethyl)-3-phenylpropanamide
CID 60953285
(2S)-2-amino-N-ethyl-N-(oxolan-3-ylmethyl)-4-phenylbutanamide
CID 104984084
N-ethyl-N-[[(3S)-oxolan-3-yl]methyl]-2-(2-oxo-3-propylbenzimidazol-1-yl)acetamide
CID 94175663
N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)butanamide
CID 51082548
N-ethyl-3-methyl-N-[[(3S)-oxolan-3-yl]methyl]butanamide
CID 94186751
(2R)-N-ethyl-N-[[(3S)-oxolan-3-yl]methyl]-2-phenylsulfanylbutanamide
CID 95621072
N-ethyl-N-(oxolan-3-ylmethyl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
CID 55745103
2-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]sulfanylacetic acid
CID 104569649
N-ethyl-2-iodo-3-methyl-N-(oxolan-3-ylmethyl)benzamide
CID 113223582
N-ethyl-2-(3-methoxyphenyl)-N-[[(3S)-oxolan-3-yl]methyl]acetamide
CID 94186811
5-[ethyl(oxolan-3-ylmethyl)amino]-3-methyl-5-oxopentanoic acid
CID 62964406
N-ethyl-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)-N-[[(3R)-oxolan-3-yl]methyl]propanamide
CID 95287110

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide?
The IUPAC name of N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide (CID 51097037) is N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide.
What is the SMILES notation for N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide?
The canonical SMILES for N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide is CCN(CC1CCOC1)C(=O)CN(CC)c1ccccc1.
What is the InChIKey of N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide?
The InChIKey is ZPDRNKSALUFFMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-18(16-8-6-5-7-9-16)13-17(20)19(4-2)12-15-10-11-21-14-15/h5-9,15H,3-4,10-14H2,1-2H3.
What are the key properties of N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide?
N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide has a molecular weight of 290.41 g/mol, XLogP of 2.40, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide is sourced from PubChem (CID 51097037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).