2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone

C14H26N2O — CID 113417562

IUPAC2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone
SMILESCC(C)C1CCN(C(=O)CC2CCCCN2)C1
InChIInChI=1S/C14H26N2O/c1-11(2)12-6-8-16(10-12)14(17)9-13-5-3-4-7-15-13/h11-13,15H,3-10H2,1-2H3
InChIKeyGIVVOFBARCPQNW-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.02
Rot. Bonds3

About 2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone

2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone (PubChem CID 113417562) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone.

Molecular Properties

Compound Name2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone
PubChem CID113417562
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone
SMILESCC(C)C1CCN(C(=O)CC2CCCCN2)C1
InChIInChI=1S/C14H26N2O/c1-11(2)12-6-8-16(10-12)14(17)9-13-5-3-4-7-15-13/h11-13,15H,3-10H2,1-2H3
InChIKeyGIVVOFBARCPQNW-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

1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone
CID 61226626
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CID 43585502
2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone
CID 29083930
2-methyl-N-[1-(2-pyrrolidin-2-ylacetyl)piperidin-4-yl]propanamide;hydrochloride
CID 119734420
1-(2-methyl-1,4-oxazepan-4-yl)-2-piperidin-2-ylethanone
CID 62972970
1-[3-(methoxymethyl)pyrrolidin-1-yl]-2-pyrrolidin-2-ylethanone
CID 64597887
1-(4-propylpiperidin-1-yl)-2-pyrrolidin-2-ylethanone
CID 62205259
2-[1-(2-piperidin-2-ylacetyl)piperidin-4-yl]acetamide
CID 54989150
1-(4-tert-butylpiperazin-1-yl)-2-piperidin-2-ylethanone
CID 61430399
1-(azocan-1-yl)-2-pyrrolidin-2-ylethanone
CID 61372180
1-(4-ethoxypiperidin-1-yl)-2-pyrrolidin-2-ylethanone
CID 61364485
1-(2-propan-2-ylpiperidin-1-yl)-2-pyrrolidin-2-ylethanone
CID 119788481

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone?
The IUPAC name of 2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone (CID 113417562) is 2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone.
What is the SMILES notation for 2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone?
The canonical SMILES for 2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone is CC(C)C1CCN(C(=O)CC2CCCCN2)C1.
What is the InChIKey of 2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone?
The InChIKey is GIVVOFBARCPQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-11(2)12-6-8-16(10-12)14(17)9-13-5-3-4-7-15-13/h11-13,15H,3-10H2,1-2H3.
What are the key properties of 2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone?
2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone 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 2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone is sourced from PubChem (CID 113417562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).