3-(dimethylamino)-1-ethylpyrrolidin-2-one

C8H16N2O — CID 20680830

IUPAC3-(dimethylamino)-1-ethylpyrrolidin-2-one
SMILESCCN1CCC(N(C)C)C1=O
InChIInChI=1S/C8H16N2O/c1-4-10-6-5-7(8(10)11)9(2)3/h7H,4-6H2,1-3H3
InChIKeyLMDPMJDZLGLYLE-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.17
Rot. Bonds2

About 3-(dimethylamino)-1-ethylpyrrolidin-2-one

3-(dimethylamino)-1-ethylpyrrolidin-2-one (PubChem CID 20680830) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 3-(dimethylamino)-1-ethylpyrrolidin-2-one.

Molecular Properties

Compound Name3-(dimethylamino)-1-ethylpyrrolidin-2-one
PubChem CID20680830
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name3-(dimethylamino)-1-ethylpyrrolidin-2-one
SMILESCCN1CCC(N(C)C)C1=O
InChIInChI=1S/C8H16N2O/c1-4-10-6-5-7(8(10)11)9(2)3/h7H,4-6H2,1-3H3
InChIKeyLMDPMJDZLGLYLE-UHFFFAOYSA-N
XLogP0.17
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-3-[ethyl(methyl)amino]pyrrolidin-2-one
CID 142616073
CID 89334130
CID 89334130
(3R)-3-bromo-1-ethylpyrrolidin-2-one
CID 86332494
1-ethyl-N-methyl-2-methylidene-N-propylpyrrolidin-3-amine
CID 156794656
N,N-diethyl-2-(1-ethyl-2-oxopyrrolidin-3-yl)prop-2-enamide
CID 139820161
(3S)-3-(aminomethyl)-1-ethylpiperidin-2-one
CID 97000487
(7aR)-2-[(3R)-1-ethyl-2-oxopyrrolidin-3-yl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione
CID 124726394
(3R)-3-[dicyclopropylmethyl(methyl)amino]-1-(2,2,2-trifluoroethyl)pyrrolidin-2-one
CID 95621630
(3R)-1,3-diethylpiperazin-2-one
CID 96645682
ethyl 2-[3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-oxopyrrolidin-1-yl]acetate
CID 135312242
(1-ethyl-3-hydroxy-2-oxo-1,3-diazinan-4-yl) cyclopropanecarboxylate
CID 155406449
1-ethyl-2-sulfonylpiperidin-4-amine
CID 87491599

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-1-ethylpyrrolidin-2-one?
The IUPAC name of 3-(dimethylamino)-1-ethylpyrrolidin-2-one (CID 20680830) is 3-(dimethylamino)-1-ethylpyrrolidin-2-one.
What is the SMILES notation for 3-(dimethylamino)-1-ethylpyrrolidin-2-one?
The canonical SMILES for 3-(dimethylamino)-1-ethylpyrrolidin-2-one is CCN1CCC(N(C)C)C1=O.
What is the InChIKey of 3-(dimethylamino)-1-ethylpyrrolidin-2-one?
The InChIKey is LMDPMJDZLGLYLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-4-10-6-5-7(8(10)11)9(2)3/h7H,4-6H2,1-3H3.
What are the key properties of 3-(dimethylamino)-1-ethylpyrrolidin-2-one?
3-(dimethylamino)-1-ethylpyrrolidin-2-one has a molecular weight of 156.23 g/mol, XLogP of 0.17, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-1-ethylpyrrolidin-2-one is sourced from PubChem (CID 20680830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).