(3-aminopyrrolidin-1-yl)-cyclopentylmethanone

C10H18N2O — CID 59657950

IUPAC(3-aminopyrrolidin-1-yl)-cyclopentylmethanone
SMILESNC1CCN(C(=O)C2CCCC2)C1
InChIInChI=1S/C10H18N2O/c11-9-5-6-12(7-9)10(13)8-3-1-2-4-8/h8-9H,1-7,11H2
InChIKeyAWEKFLBBQMOTJB-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.74
Rot. Bonds1

About (3-aminopyrrolidin-1-yl)-cyclopentylmethanone

(3-aminopyrrolidin-1-yl)-cyclopentylmethanone (PubChem CID 59657950) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is (3-aminopyrrolidin-1-yl)-cyclopentylmethanone.

Molecular Properties

Compound Name(3-aminopyrrolidin-1-yl)-cyclopentylmethanone
PubChem CID59657950
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name(3-aminopyrrolidin-1-yl)-cyclopentylmethanone
SMILESNC1CCN(C(=O)C2CCCC2)C1
InChIInChI=1S/C10H18N2O/c11-9-5-6-12(7-9)10(13)8-3-1-2-4-8/h8-9H,1-7,11H2
InChIKeyAWEKFLBBQMOTJB-UHFFFAOYSA-N
XLogP0.74
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3-aminopyrrolidin-1-yl)-cyclopentylmethanone?
The IUPAC name of (3-aminopyrrolidin-1-yl)-cyclopentylmethanone (CID 59657950) is (3-aminopyrrolidin-1-yl)-cyclopentylmethanone.
What is the SMILES notation for (3-aminopyrrolidin-1-yl)-cyclopentylmethanone?
The canonical SMILES for (3-aminopyrrolidin-1-yl)-cyclopentylmethanone is NC1CCN(C(=O)C2CCCC2)C1.
What is the InChIKey of (3-aminopyrrolidin-1-yl)-cyclopentylmethanone?
The InChIKey is AWEKFLBBQMOTJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c11-9-5-6-12(7-9)10(13)8-3-1-2-4-8/h8-9H,1-7,11H2.
What are the key properties of (3-aminopyrrolidin-1-yl)-cyclopentylmethanone?
(3-aminopyrrolidin-1-yl)-cyclopentylmethanone has a molecular weight of 182.27 g/mol, XLogP of 0.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminopyrrolidin-1-yl)-cyclopentylmethanone is sourced from PubChem (CID 59657950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).