3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one

C10H19NO2 — CID 116565198

IUPAC3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one
SMILESCCNCC(C)C(=O)C1CCOC1
InChIInChI=1S/C10H19NO2/c1-3-11-6-8(2)10(12)9-4-5-13-7-9/h8-9,11H,3-7H2,1-2H3
InChIKeyFLZUXBVPHHQIPJ-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.84
Rot. Bonds5

About 3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one

3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one (PubChem CID 116565198) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one.

Molecular Properties

Compound Name3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one
PubChem CID116565198
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one
SMILESCCNCC(C)C(=O)C1CCOC1
InChIInChI=1S/C10H19NO2/c1-3-11-6-8(2)10(12)9-4-5-13-7-9/h8-9,11H,3-7H2,1-2H3
InChIKeyFLZUXBVPHHQIPJ-UHFFFAOYSA-N
XLogP0.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-1-[(3S)-oxolan-3-yl]propan-1-one
CID 58423021
(2S)-2-bromo-1-[(3R)-oxolan-3-yl]propan-1-one
CID 124710732
2-amino-3-methyl-1-(oxolan-3-yl)pentan-1-one
CID 116552686
2-amino-3-methyl-1-(oxolan-3-yl)butan-1-one
CID 116548922
N-[(2R)-2-hydroxypropyl]oxolane-3-carboxamide
CID 83032356
(3R)-N-[(2R)-heptan-2-yl]oxolane-3-carboxamide
CID 95271153
3-methyl-1-(oxolan-3-yl)-2-phenylpentan-1-one
CID 114972015
3-methyl-1-(oxolan-3-yl)pentan-1-one
CID 65330399
N-[2-(methylamino)propyl]oxolane-3-carboxamide
CID 103512805
2-(oxolane-3-carbonylamino)hexanoic acid
CID 61271265
N-cyclobutyl-3-(ethylamino)-2-methylpropanamide
CID 62839829
2-(azetidin-3-yl)-1-(oxolan-3-yl)propan-1-one
CID 116680683

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one?
The IUPAC name of 3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one (CID 116565198) is 3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one.
What is the SMILES notation for 3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one?
The canonical SMILES for 3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one is CCNCC(C)C(=O)C1CCOC1.
What is the InChIKey of 3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one?
The InChIKey is FLZUXBVPHHQIPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-11-6-8(2)10(12)9-4-5-13-7-9/h8-9,11H,3-7H2,1-2H3.
What are the key properties of 3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one?
3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one has a molecular weight of 185.27 g/mol, XLogP of 0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one is sourced from PubChem (CID 116565198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).