1-ethenyl-3,3-diethylpyrrolidin-2-one

C10H17NO — CID 18175994

IUPAC1-ethenyl-3,3-diethylpyrrolidin-2-one
SMILESC=CN1CCC(CC)(CC)C1=O
InChIInChI=1S/C10H17NO/c1-4-10(5-2)7-8-11(6-3)9(10)12/h6H,3-5,7-8H2,1-2H3
InChIKeyYVXKHPHLMBCHCV-UHFFFAOYSA-N
MW167.25 g/mol
LogP2.17
Rot. Bonds3

About 1-ethenyl-3,3-diethylpyrrolidin-2-one

1-ethenyl-3,3-diethylpyrrolidin-2-one (PubChem CID 18175994) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 1-ethenyl-3,3-diethylpyrrolidin-2-one.

Molecular Properties

Compound Name1-ethenyl-3,3-diethylpyrrolidin-2-one
PubChem CID18175994
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name1-ethenyl-3,3-diethylpyrrolidin-2-one
SMILESC=CN1CCC(CC)(CC)C1=O
InChIInChI=1S/C10H17NO/c1-4-10(5-2)7-8-11(6-3)9(10)12/h6H,3-5,7-8H2,1-2H3
InChIKeyYVXKHPHLMBCHCV-UHFFFAOYSA-N
XLogP2.17
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-Ethyl-1-vinyl-2-pyrrolidone
CID 14205343
3-(2,2-Dimethylpropanoyl)-1-ethenyl-3-methylpyrrolidin-2-one
CID 134894534
1-Ethenyl-3,3-dimethylpyrrolidin-2-one
CID 13847893
3-Butyl-1-ethenylpyrrolidin-2-one
CID 14205344
2-Pyrrolidinone, 1-ethenyl-4,5-dimethyl-
CID 14205345
1-Ethenyl-4-propylpyrrolidin-2-one
CID 18186024
3-Ethyl-1,3-dimethylpyrrolidin-2-one
CID 18784905
1-Ethenyl-4,4-dimethylpyrrolidin-2-one
CID 19795402
4-Ethyl-1-vinylpyrrolidin-2-one
CID 21924704
1-Ethenyl-3,3,5-trimethylpyrrolidin-2-one
CID 21924727
1-Ethenyl-5,5-dimethylpyrrolidin-2-one
CID 21924730
1-Ethenyl-3-propylpyrrolidin-2-one
CID 22259528

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-3,3-diethylpyrrolidin-2-one?
The IUPAC name of 1-ethenyl-3,3-diethylpyrrolidin-2-one (CID 18175994) is 1-ethenyl-3,3-diethylpyrrolidin-2-one.
What is the SMILES notation for 1-ethenyl-3,3-diethylpyrrolidin-2-one?
The canonical SMILES for 1-ethenyl-3,3-diethylpyrrolidin-2-one is C=CN1CCC(CC)(CC)C1=O.
What is the InChIKey of 1-ethenyl-3,3-diethylpyrrolidin-2-one?
The InChIKey is YVXKHPHLMBCHCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-4-10(5-2)7-8-11(6-3)9(10)12/h6H,3-5,7-8H2,1-2H3.
What are the key properties of 1-ethenyl-3,3-diethylpyrrolidin-2-one?
1-ethenyl-3,3-diethylpyrrolidin-2-one has a molecular weight of 167.25 g/mol, XLogP of 2.17, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-3,3-diethylpyrrolidin-2-one is sourced from PubChem (CID 18175994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).