2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone

C15H24N2O — CID 121184194

IUPAC2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone
SMILESO=C(CN1CCC(=C2CC2)CC1)N1CCCCC1
InChIInChI=1S/C15H24N2O/c18-15(17-8-2-1-3-9-17)12-16-10-6-14(7-11-16)13-4-5-13/h1-12H2
InChIKeyIWCTYASSNJIQHO-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.19
Rot. Bonds2

About 2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone

2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone (PubChem CID 121184194) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone.

Molecular Properties

Compound Name2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone
PubChem CID121184194
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone
SMILESO=C(CN1CCC(=C2CC2)CC1)N1CCCCC1
InChIInChI=1S/C15H24N2O/c18-15(17-8-2-1-3-9-17)12-16-10-6-14(7-11-16)13-4-5-13/h1-12H2
InChIKeyIWCTYASSNJIQHO-UHFFFAOYSA-N
XLogP2.19
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(azetidin-1-yl)-2-pyrrolidin-1-ylethanone
CID 91265703
2-(azetidin-1-yl)-1-pyrrolidin-1-ylethanone
CID 130618835
oxalic acid;2-piperidin-1-yl-1-[4-(2-piperidin-1-ylacetyl)piperazin-1-yl]ethanone
CID 171669466
1-(azepan-1-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone
CID 60645190
methane;nonakis(2-(4-methylpiperazin-1-yl)-1-piperidin-1-ylethanone)
CID 157103397
2-(4-acetylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone
CID 14226088
2-(4-aminopiperazin-1-yl)-1-pyrrolidin-1-ylethanone
CID 71131603
4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazine-1-carboxylic acid
CID 22047729
1-[2-(azocan-1-yl)-2-oxoethyl]piperidine-4-carboxylic acid
CID 43441474
2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-1-(azepan-1-yl)ethanone
CID 107160703
2-(4-methylpiperidin-1-yl)-1-pyrrolidin-1-ylethanone
CID 39903910
3-piperidin-1-yl-1-[4-(2-piperidin-1-ylacetyl)piperazin-1-yl]propan-1-one
CID 3021273

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone?
The IUPAC name of 2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone (CID 121184194) is 2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone.
What is the SMILES notation for 2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone?
The canonical SMILES for 2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone is O=C(CN1CCC(=C2CC2)CC1)N1CCCCC1.
What is the InChIKey of 2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone?
The InChIKey is IWCTYASSNJIQHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c18-15(17-8-2-1-3-9-17)12-16-10-6-14(7-11-16)13-4-5-13/h1-12H2.
What are the key properties of 2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone?
2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone has a molecular weight of 248.37 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylidenepiperidin-1-yl)-1-piperidin-1-ylethanone is sourced from PubChem (CID 121184194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).