1-cyclopropyl-2-methylidenepiperidin-4-one

C9H13NO — CID 141460432

IUPAC1-cyclopropyl-2-methylidenepiperidin-4-one
SMILESC=C1CC(=O)CCN1C1CC1
InChIInChI=1S/C9H13NO/c1-7-6-9(11)4-5-10(7)8-2-3-8/h8H,1-6H2
InChIKeyRMRDVPQYFWKKOB-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.33
Rot. Bonds1

About 1-cyclopropyl-2-methylidenepiperidin-4-one

1-cyclopropyl-2-methylidenepiperidin-4-one (PubChem CID 141460432) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 1-cyclopropyl-2-methylidenepiperidin-4-one.

Molecular Properties

Compound Name1-cyclopropyl-2-methylidenepiperidin-4-one
PubChem CID141460432
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name1-cyclopropyl-2-methylidenepiperidin-4-one
SMILESC=C1CC(=O)CCN1C1CC1
InChIInChI=1S/C9H13NO/c1-7-6-9(11)4-5-10(7)8-2-3-8/h8H,1-6H2
InChIKeyRMRDVPQYFWKKOB-UHFFFAOYSA-N
XLogP1.33
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-methylidenepiperidin-4-one?
The IUPAC name of 1-cyclopropyl-2-methylidenepiperidin-4-one (CID 141460432) is 1-cyclopropyl-2-methylidenepiperidin-4-one.
What is the SMILES notation for 1-cyclopropyl-2-methylidenepiperidin-4-one?
The canonical SMILES for 1-cyclopropyl-2-methylidenepiperidin-4-one is C=C1CC(=O)CCN1C1CC1.
What is the InChIKey of 1-cyclopropyl-2-methylidenepiperidin-4-one?
The InChIKey is RMRDVPQYFWKKOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-7-6-9(11)4-5-10(7)8-2-3-8/h8H,1-6H2.
What are the key properties of 1-cyclopropyl-2-methylidenepiperidin-4-one?
1-cyclopropyl-2-methylidenepiperidin-4-one has a molecular weight of 151.21 g/mol, XLogP of 1.33, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-methylidenepiperidin-4-one is sourced from PubChem (CID 141460432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).