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

C12H22N2O — CID 61226626

IUPAC1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone
SMILESCC1CCN(C(=O)CC2CCCCN2)C1
InChIInChI=1S/C12H22N2O/c1-10-5-7-14(9-10)12(15)8-11-4-2-3-6-13-11/h10-11,13H,2-9H2,1H3
InChIKeyWPYNFOPKQOSATA-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.39
Rot. Bonds2

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

1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone (PubChem CID 61226626) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone.

Molecular Properties

Compound Name1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone
PubChem CID61226626
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone
SMILESCC1CCN(C(=O)CC2CCCCN2)C1
InChIInChI=1S/C12H22N2O/c1-10-5-7-14(9-10)12(15)8-11-4-2-3-6-13-11/h10-11,13H,2-9H2,1H3
InChIKeyWPYNFOPKQOSATA-UHFFFAOYSA-N
XLogP1.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-piperidin-2-yl-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone
CID 113417562
2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone
CID 29083930
1-(2-methyl-1,4-oxazepan-4-yl)-2-piperidin-2-ylethanone
CID 62972970
1-[4-(3-methylpiperidine-1-carbonyl)piperidin-1-yl]-2-pyrrolidin-2-ylethanone
CID 119733147
1-(2-methylmorpholin-4-yl)-2-pyrrolidin-2-ylethanone;hydrochloride
CID 119698735
1-[4-(4-methylpiperidine-1-carbonyl)piperidin-1-yl]-2-pyrrolidin-2-ylethanone;hydrochloride
CID 119738163
1-[3-(methoxymethyl)pyrrolidin-1-yl]-2-pyrrolidin-2-ylethanone
CID 64597887
2-piperidin-2-yl-1-(4-propan-2-ylpiperazin-1-yl)ethanone
CID 43585502
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-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone
CID 104958689
1-(2-methylpiperidin-1-yl)-2-piperidin-2-ylethanone
CID 43151335

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone?
The IUPAC name of 1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone (CID 61226626) is 1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone.
What is the SMILES notation for 1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone?
The canonical SMILES for 1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone is CC1CCN(C(=O)CC2CCCCN2)C1.
What is the InChIKey of 1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone?
The InChIKey is WPYNFOPKQOSATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-10-5-7-14(9-10)12(15)8-11-4-2-3-6-13-11/h10-11,13H,2-9H2,1H3.
What are the key properties of 1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone?
1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone has a molecular weight of 210.32 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylpyrrolidin-1-yl)-2-piperidin-2-ylethanone is sourced from PubChem (CID 61226626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).