1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one

C14H24N2O2 — CID 113003020

IUPAC1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one
SMILESCCC(=O)N1CCC(C(=O)N2CCCCC2)CC1
InChIInChI=1S/C14H24N2O2/c1-2-13(17)15-10-6-12(7-11-15)14(18)16-8-4-3-5-9-16/h12H,2-11H2,1H3
InChIKeyPPXXRUZRQNDLHV-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.65
Rot. Bonds2

About 1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one

1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one (PubChem CID 113003020) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one.

Molecular Properties

Compound Name1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one
PubChem CID113003020
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one
SMILESCCC(=O)N1CCC(C(=O)N2CCCCC2)CC1
InChIInChI=1S/C14H24N2O2/c1-2-13(17)15-10-6-12(7-11-15)14(18)16-8-4-3-5-9-16/h12H,2-11H2,1H3
InChIKeyPPXXRUZRQNDLHV-UHFFFAOYSA-N
XLogP1.65
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(cyclobutanecarbonyl)-1,4-diazepan-1-yl]propan-1-one
CID 110796478
1-(1-propanoylpiperidine-4-carbonyl)piperidine-3-carboxamide
CID 131937805
1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
CID 110604424
1-(azepan-1-yl)propan-1-one
CID 3613534
1-[4-[1-(2,2,2-trifluoroacetyl)piperidine-4-carbonyl]-1,4-diazepan-1-yl]propan-1-one
CID 110796472
methane;bis(1-piperidin-1-ylpropan-1-one);1-pyrrolidin-1-ylpropan-1-one
CID 158630764
4-(1-propanoylpiperidine-4-carbonyl)piperazine-1-carbaldehyde
CID 113003741
1-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-chloroethanone
CID 52908095
[4-(azepane-1-carbonyl)piperidin-1-yl]-cyclopentylmethanone
CID 134029844
1-(4-propanoyl-1,4-diazocan-1-yl)propan-1-one
CID 146415893
1-[4-[4-(ethoxymethyl)piperidine-1-carbonyl]piperidin-1-yl]propan-1-one
CID 131909918
1-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-cyclohexylethanone
CID 134029886

Frequently Asked Questions

What is the IUPAC name of 1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one?
The IUPAC name of 1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one (CID 113003020) is 1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one.
What is the SMILES notation for 1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one?
The canonical SMILES for 1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one is CCC(=O)N1CCC(C(=O)N2CCCCC2)CC1.
What is the InChIKey of 1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one?
The InChIKey is PPXXRUZRQNDLHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-2-13(17)15-10-6-12(7-11-15)14(18)16-8-4-3-5-9-16/h12H,2-11H2,1H3.
What are the key properties of 1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one?
1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one has a molecular weight of 252.36 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one is sourced from PubChem (CID 113003020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).