1-(3-aminoprop-2-enyl)piperidin-2-one

C8H14N2O — CID 67823451

IUPAC1-(3-aminoprop-2-enyl)piperidin-2-one
SMILESNC=CCN1CCCCC1=O
InChIInChI=1S/C8H14N2O/c9-5-3-7-10-6-2-1-4-8(10)11/h3,5H,1-2,4,6-7,9H2
InChIKeyFLPPZAGVMYZMSM-UHFFFAOYSA-N
MW154.21 g/mol
LogP0.47
Rot. Bonds2

About 1-(3-aminoprop-2-enyl)piperidin-2-one

1-(3-aminoprop-2-enyl)piperidin-2-one (PubChem CID 67823451) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 1-(3-aminoprop-2-enyl)piperidin-2-one.

Molecular Properties

Compound Name1-(3-aminoprop-2-enyl)piperidin-2-one
PubChem CID67823451
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name1-(3-aminoprop-2-enyl)piperidin-2-one
SMILESNC=CCN1CCCCC1=O
InChIInChI=1S/C8H14N2O/c9-5-3-7-10-6-2-1-4-8(10)11/h3,5H,1-2,4,6-7,9H2
InChIKeyFLPPZAGVMYZMSM-UHFFFAOYSA-N
XLogP0.47
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-aminoprop-2-enyl)pyrrolidin-2-one
CID 67120003
1-[(E)-3-aminoprop-2-enyl]pyrrolidin-2-one
CID 87276105
1-[(2-oxoazepan-1-yl)methyl]azepan-2-one
CID 11746692
azane;1-prop-2-enylpyrrolidin-2-one
CID 174828980
1-ethylpyrrolidin-2-one;hydrazine
CID 159147234
1-(chloromethyl)azonan-2-one
CID 23348579
carbamodithioic acid;1-prop-2-enylpyrrolidin-2-one
CID 175478973
1-but-3-enylpiperidin-2-one
CID 14225189
1-(2-pyrrolidin-1-ylprop-2-enyl)azepan-2-one
CID 142011041
1-(4-hydroxybutyl)azepan-2-one
CID 43509760
1-prop-2-ynylazocan-2-one
CID 61344680
methyl 2-methyl-4-(2-oxoazepan-1-yl)but-2-enoate
CID 77074806

Frequently Asked Questions

What is the IUPAC name of 1-(3-aminoprop-2-enyl)piperidin-2-one?
The IUPAC name of 1-(3-aminoprop-2-enyl)piperidin-2-one (CID 67823451) is 1-(3-aminoprop-2-enyl)piperidin-2-one.
What is the SMILES notation for 1-(3-aminoprop-2-enyl)piperidin-2-one?
The canonical SMILES for 1-(3-aminoprop-2-enyl)piperidin-2-one is NC=CCN1CCCCC1=O.
What is the InChIKey of 1-(3-aminoprop-2-enyl)piperidin-2-one?
The InChIKey is FLPPZAGVMYZMSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c9-5-3-7-10-6-2-1-4-8(10)11/h3,5H,1-2,4,6-7,9H2.
What are the key properties of 1-(3-aminoprop-2-enyl)piperidin-2-one?
1-(3-aminoprop-2-enyl)piperidin-2-one has a molecular weight of 154.21 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminoprop-2-enyl)piperidin-2-one is sourced from PubChem (CID 67823451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).