[(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride

C9H15ClF2N2O — CID 165368966

IUPAC[(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride
SMILESCl.N[C@@H]1CCCN(C(=O)C2CC2(F)F)C1
InChIInChI=1S/C9H14F2N2O.ClH/c10-9(11)4-7(9)8(14)13-3-1-2-6(12)5-13;/h6-7H,1-5,12H2;1H/t6-,7?;/m1./s1
InChIKeyRQJDZJRYRUCOQG-JVEOKNEYSA-N
MW240.68 g/mol
LogP1.01
Rot. Bonds1

About [(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride

[(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride (PubChem CID 165368966) has the molecular formula C9H15ClF2N2O and a molecular weight of 240.68 g/mol. Its IUPAC name is [(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride.

Molecular Properties

Compound Name[(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride
PubChem CID165368966
Molecular FormulaC9H15ClF2N2O
Molecular Weight240.68 g/mol
Exact Mass240.08
IUPAC Name[(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride
SMILESCl.N[C@@H]1CCCN(C(=O)C2CC2(F)F)C1
InChIInChI=1S/C9H14F2N2O.ClH/c10-9(11)4-7(9)8(14)13-3-1-2-6(12)5-13;/h6-7H,1-5,12H2;1H/t6-,7?;/m1./s1
InChIKeyRQJDZJRYRUCOQG-JVEOKNEYSA-N
XLogP1.01
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.68
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)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

(3-aminopiperidin-1-yl)-(2,2-dichlorocyclopropyl)methanone;hydrochloride
CID 130874964
[(3S)-3-aminopiperidin-1-yl]-(3,3-difluorocyclobutyl)methanone;hydrochloride
CID 166595294
(3-aminopiperidin-1-yl)-(2-ethyl-2-methylcyclopropyl)methanone
CID 119379514
3-aminopiperidine-1-carboxamide;hydrochloride
CID 141463917
(3-aminopiperidin-1-yl)-(4-hydroxycyclohexyl)methanone
CID 112531005
[3-(aminomethyl)piperidin-1-yl]-(3,3-difluorocyclobutyl)methanone;hydrochloride
CID 166595296
(3-aminopiperidin-1-yl)-pyrrolidin-1-ylmethanone
CID 79161440
(3-aminopiperidin-1-yl)-(1-methylpiperidin-3-yl)methanone
CID 121200535
(3-aminopiperidin-1-yl)-(4-methylcyclohexyl)methanone
CID 81458507
[(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride
CID 131163040
[(3R,4S)-3-amino-4-fluoropyrrolidin-1-yl]-(2,2-difluorocyclopropyl)methanone
CID 170075818
3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid
CID 103550534

Frequently Asked Questions

What is the IUPAC name of [(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride?
The IUPAC name of [(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride (CID 165368966) is [(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride.
What is the SMILES notation for [(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride?
The canonical SMILES for [(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride is Cl.N[C@@H]1CCCN(C(=O)C2CC2(F)F)C1.
What is the InChIKey of [(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride?
The InChIKey is RQJDZJRYRUCOQG-JVEOKNEYSA-N. The full InChI is InChI=1S/C9H14F2N2O.ClH/c10-9(11)4-7(9)8(14)13-3-1-2-6(12)5-13;/h6-7H,1-5,12H2;1H/t6-,7?;/m1./s1.
What are the key properties of [(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride?
[(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride has a molecular weight of 240.68 g/mol, XLogP of 1.01, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-aminopiperidin-1-yl]-(2,2-difluorocyclopropyl)methanone;hydrochloride is sourced from PubChem (CID 165368966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).