1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone

C14H26N2O — CID 62689348

IUPAC1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone
SMILESCCC1CCCN(C(=O)CC2CCCNC2)C1
InChIInChI=1S/C14H26N2O/c1-2-12-6-4-8-16(11-12)14(17)9-13-5-3-7-15-10-13/h12-13,15H,2-11H2,1H3
InChIKeyXPCFAHFNWLSRAO-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.02
Rot. Bonds3

About 1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone

1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone (PubChem CID 62689348) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone.

Molecular Properties

Compound Name1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone
PubChem CID62689348
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone
SMILESCCC1CCCN(C(=O)CC2CCCNC2)C1
InChIInChI=1S/C14H26N2O/c1-2-12-6-4-8-16(11-12)14(17)9-13-5-3-7-15-10-13/h12-13,15H,2-11H2,1H3
InChIKeyXPCFAHFNWLSRAO-UHFFFAOYSA-N
XLogP2.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azetidin-3-yl)-1-(3-ethylpyrrolidin-1-yl)ethanone
CID 115740816
[1-(2-piperidin-3-ylacetyl)piperidin-3-yl]methylurea
CID 62674376
1-(3-methoxypyrrolidin-1-yl)-2-piperidin-3-ylethanone
CID 103532971
2-(azetidin-3-yl)-1-[3-(hydroxymethyl)piperidin-1-yl]ethanone
CID 64616768
1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-piperidin-3-ylethanone
CID 106835886
methyl 1-(2-piperidin-3-ylacetyl)piperidine-4-carboxylate
CID 62674333
1-(4-ethoxypiperidin-1-yl)-2-piperidin-3-ylethanone
CID 62691409
1-(4-methoxypiperidin-1-yl)-2-piperidin-3-ylethanone
CID 62690713
1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone
CID 62691071
1-(3-ethylpyrrolidin-1-yl)-3-pyrrolidin-3-ylpropan-1-one
CID 115774867
N-[[1-[2-(azetidin-3-yl)acetyl]piperidin-3-yl]methyl]methanesulfonamide
CID 64609955
1-[(3R)-3-ethylpiperidin-1-yl]-2-methoxyethanone
CID 155354237

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone?
The IUPAC name of 1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone (CID 62689348) is 1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone.
What is the SMILES notation for 1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone?
The canonical SMILES for 1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone is CCC1CCCN(C(=O)CC2CCCNC2)C1.
What is the InChIKey of 1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone?
The InChIKey is XPCFAHFNWLSRAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-2-12-6-4-8-16(11-12)14(17)9-13-5-3-7-15-10-13/h12-13,15H,2-11H2,1H3.
What are the key properties of 1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone?
1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone has a molecular weight of 238.37 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone is sourced from PubChem (CID 62689348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).