(2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone

C14H25N3O — CID 63103464

IUPAC(2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone
SMILESO=C(C1CNCCN1)N1CCCC1C1CCCC1
InChIInChI=1S/C14H25N3O/c18-14(12-10-15-7-8-16-12)17-9-3-6-13(17)11-4-1-2-5-11/h11-13,15-16H,1-10H2
InChIKeyUFIOJAKIAPJBPY-UHFFFAOYSA-N
MW251.37 g/mol
LogP0.73
Rot. Bonds2

About (2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone

(2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone (PubChem CID 63103464) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is (2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone.

Molecular Properties

Compound Name(2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone
PubChem CID63103464
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name(2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone
SMILESO=C(C1CNCCN1)N1CCCC1C1CCCC1
InChIInChI=1S/C14H25N3O/c18-14(12-10-15-7-8-16-12)17-9-3-6-13(17)11-4-1-2-5-11/h11-13,15-16H,1-10H2
InChIKeyUFIOJAKIAPJBPY-UHFFFAOYSA-N
XLogP0.73
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

azepan-2-yl-(2-cyclopentylpyrrolidin-1-yl)methanone
CID 64569542
[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-piperidin-3-ylmethanone
CID 102726290
[2-(hydroxymethyl)pyrrolidin-1-yl]-piperazin-2-ylmethanone
CID 63103994
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl(thiomorpholin-3-yl)methanone
CID 82916769
2,3,3a,4,5,6,7,7a-octahydroindol-1-yl-(4-methylpiperidin-2-yl)methanone
CID 114424404
(2-cyclobutylpyrrolidin-1-yl)-piperidin-3-ylmethanone;hydrochloride
CID 119313249
2,3,3a,4,5,6,7,7a-octahydro-1H-indol-2-yl(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)methanone
CID 43628220
cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone
CID 110871989
3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl-[(2S,4S)-2-methylpiperidin-4-yl]methanone
CID 120617962
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl-[5-(trifluoromethyl)piperidin-2-yl]methanone
CID 114908901
1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-methyl-2-piperidin-3-ylpropan-1-one
CID 102726190
azocan-1-yl(piperazin-2-yl)methanone
CID 63104167

Frequently Asked Questions

What is the IUPAC name of (2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone?
The IUPAC name of (2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone (CID 63103464) is (2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone.
What is the SMILES notation for (2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone?
The canonical SMILES for (2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone is O=C(C1CNCCN1)N1CCCC1C1CCCC1.
What is the InChIKey of (2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone?
The InChIKey is UFIOJAKIAPJBPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c18-14(12-10-15-7-8-16-12)17-9-3-6-13(17)11-4-1-2-5-11/h11-13,15-16H,1-10H2.
What are the key properties of (2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone?
(2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone has a molecular weight of 251.37 g/mol, XLogP of 0.73, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopentylpyrrolidin-1-yl)-piperazin-2-ylmethanone is sourced from PubChem (CID 63103464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).