[(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride

C11H19ClF2N2O — CID 154910969

IUPAC[(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride
SMILESCl.N[C@@H]1CC[C@H](C(=O)N2CCC(F)(F)CC2)C1
InChIInChI=1S/C11H18F2N2O.ClH/c12-11(13)3-5-15(6-4-11)10(16)8-1-2-9(14)7-8;/h8-9H,1-7,14H2;1H/t8-,9+;/m0./s1
InChIKeyWFFUFJGSFPALOW-OULXEKPRSA-N
MW268.73 g/mol
LogP1.79
Rot. Bonds1

About [(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride

[(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride (PubChem CID 154910969) has the molecular formula C11H19ClF2N2O and a molecular weight of 268.73 g/mol. Its IUPAC name is [(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride.

Molecular Properties

Compound Name[(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride
PubChem CID154910969
Molecular FormulaC11H19ClF2N2O
Molecular Weight268.73 g/mol
Exact Mass268.12
IUPAC Name[(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride
SMILESCl.N[C@@H]1CC[C@H](C(=O)N2CCC(F)(F)CC2)C1
InChIInChI=1S/C11H18F2N2O.ClH/c12-11(13)3-5-15(6-4-11)10(16)8-1-2-9(14)7-8;/h8-9H,1-7,14H2;1H/t8-,9+;/m0./s1
InChIKeyWFFUFJGSFPALOW-OULXEKPRSA-N
XLogP1.79
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.73
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(1S,3S)-3-aminocyclopentyl]-pyrrolidin-1-ylmethanone
CID 97030843
(3-aminocyclopentyl)-(azetidin-1-yl)methanone
CID 130546940
(3-aminocyclopentyl)-(4,4-diethylpiperidin-1-yl)methanone
CID 66010680
[4-(3-aminocyclopentanecarbonyl)piperazin-1-yl]-cyclohexylmethanone;hydrochloride
CID 119755471
(3-aminocyclopentyl)-(7,7-dimethyl-1,4-thiazepan-4-yl)methanone
CID 107454532
1-(3-aminocyclopentanecarbonyl)piperidine-4-carboxamide
CID 66030476
(3-aminocyclopentyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone;dihydrochloride
CID 119831557
(3-aminocyclopentyl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone
CID 66032292
(3-aminocyclohexyl)-(azepan-1-yl)methanone;hydrochloride
CID 119669540
[(1R,3S)-3-aminocyclohexyl]-(4-fluoropiperidin-1-yl)methanone;hydrochloride
CID 154910496
(3-aminocyclopentyl)-(3,5-dimethylpiperidin-1-yl)methanone
CID 66032470
(3-aminocyclopentyl)-(4-tert-butylpiperidin-1-yl)methanone
CID 66009012

Frequently Asked Questions

What is the IUPAC name of [(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride?
The IUPAC name of [(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride (CID 154910969) is [(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride.
What is the SMILES notation for [(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride?
The canonical SMILES for [(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride is Cl.N[C@@H]1CC[C@H](C(=O)N2CCC(F)(F)CC2)C1.
What is the InChIKey of [(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride?
The InChIKey is WFFUFJGSFPALOW-OULXEKPRSA-N. The full InChI is InChI=1S/C11H18F2N2O.ClH/c12-11(13)3-5-15(6-4-11)10(16)8-1-2-9(14)7-8;/h8-9H,1-7,14H2;1H/t8-,9+;/m0./s1.
What are the key properties of [(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride?
[(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride has a molecular weight of 268.73 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,3R)-3-aminocyclopentyl]-(4,4-difluoropiperidin-1-yl)methanone;hydrochloride is sourced from PubChem (CID 154910969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).