2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone

C13H24N2O — CID 64678965

IUPAC2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone
SMILESCCC1CCCN1C(=O)CC1(N)CCCC1
InChIInChI=1S/C13H24N2O/c1-2-11-6-5-9-15(11)12(16)10-13(14)7-3-4-8-13/h11H,2-10,14H2,1H3
InChIKeyXGPULQVBSMMPLP-UHFFFAOYSA-N
MW224.35 g/mol
LogP2.05
Rot. Bonds3

About 2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone

2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone (PubChem CID 64678965) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone
PubChem CID64678965
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone
SMILESCCC1CCCN1C(=O)CC1(N)CCCC1
InChIInChI=1S/C13H24N2O/c1-2-11-6-5-9-15(11)12(16)10-13(14)7-3-4-8-13/h11H,2-10,14H2,1H3
InChIKeyXGPULQVBSMMPLP-UHFFFAOYSA-N
XLogP2.05
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-aminocyclohexyl)-1-(2-ethylazepan-1-yl)ethanone
CID 104689647
2-(1-aminocyclobutyl)-1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethanone
CID 79854828
1-(2-ethylpyrrolidin-1-yl)-2-[1-(methylamino)cyclohexyl]ethanone
CID 65242450
2-(1-aminocyclopentyl)-1-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone
CID 64684748
2-(1-aminocyclohexyl)-1-(3-ethylmorpholin-4-yl)ethanone
CID 64684792
2-[1-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]cyclopentyl]acetic acid
CID 3655382
(2R)-1-[2-(1-aminocyclohexyl)acetyl]pyrrolidine-2-carboxylic acid
CID 64677043
1-(2-ethylpyrrolidin-1-yl)butan-1-one
CID 63083979
2-(1-aminocyclobutyl)-1-(2-benzylpyrrolidin-1-yl)ethanone
CID 79854779
1-[2-(1-aminocyclohexyl)acetyl]-3-methylpiperidine-2-carboxylic acid
CID 107068866
2-chloro-1-[(2R)-2-ethylpiperidin-1-yl]ethanone
CID 7628883
1-[(2R)-2-ethylpiperidin-1-yl]propan-1-one
CID 40538705

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone?
The IUPAC name of 2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone (CID 64678965) is 2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone.
What is the SMILES notation for 2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone?
The canonical SMILES for 2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone is CCC1CCCN1C(=O)CC1(N)CCCC1.
What is the InChIKey of 2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone?
The InChIKey is XGPULQVBSMMPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-2-11-6-5-9-15(11)12(16)10-13(14)7-3-4-8-13/h11H,2-10,14H2,1H3.
What are the key properties of 2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone?
2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone has a molecular weight of 224.35 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-1-(2-ethylpyrrolidin-1-yl)ethanone is sourced from PubChem (CID 64678965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).