[(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride

C10H20ClN3O — CID 131163040

IUPAC[(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride
SMILESCl.N[C@@H]1CCCN(C(=O)C2CCNC2)C1
InChIInChI=1S/C10H19N3O.ClH/c11-9-2-1-5-13(7-9)10(14)8-3-4-12-6-8;/h8-9,12H,1-7,11H2;1H/t8?,9-;/m1./s1
InChIKeyMDDGQAFFATXNLF-ICLMXVQUSA-N
MW233.74 g/mol
LogP-0.03
Rot. Bonds1

About [(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride

[(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride (PubChem CID 131163040) has the molecular formula C10H20ClN3O and a molecular weight of 233.74 g/mol. Its IUPAC name is [(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride.

Molecular Properties

Compound Name[(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride
PubChem CID131163040
Molecular FormulaC10H20ClN3O
Molecular Weight233.74 g/mol
Exact Mass233.13
IUPAC Name[(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride
SMILESCl.N[C@@H]1CCCN(C(=O)C2CCNC2)C1
InChIInChI=1S/C10H19N3O.ClH/c11-9-2-1-5-13(7-9)10(14)8-3-4-12-6-8;/h8-9,12H,1-7,11H2;1H/t8?,9-;/m1./s1
InChIKeyMDDGQAFFATXNLF-ICLMXVQUSA-N
XLogP-0.03
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.74
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

pyrrolidin-1-yl(pyrrolidin-3-yl)methanone;hydrochloride
CID 67294247
[(3S)-3-hydroxypiperidin-1-yl]-pyrrolidin-3-ylmethanone
CID 107222844
2-[1-(pyrrolidine-3-carbonyl)piperidin-3-yl]acetic acid
CID 63005504
[(3S)-3-fluoropiperidin-1-yl]-[(3S)-pyrrolidin-3-yl]methanone
CID 129494555
(3R)-1-(pyrrolidine-3-carbonyl)piperidine-3-carboxylic acid
CID 81120944
[3-[(2-methylpiperidin-1-yl)methyl]piperidin-1-yl]-pyrrolidin-3-ylmethanone;dihydrochloride
CID 119867686
pyrrolidin-3-yl-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone
CID 119892585
[(3S)-pyrrolidin-3-yl]-[(3R)-3-(trifluoromethyl)piperidin-1-yl]methanone
CID 94916279
(3-methoxypiperidin-1-yl)-pyrrolidin-3-ylmethanone
CID 103809318
[3-(1-hydroxyethyl)piperidin-1-yl]-pyrrolidin-3-ylmethanone
CID 121201689
piperidin-3-yl-(3-propylpiperidin-1-yl)methanone;hydrochloride
CID 119337253
[(3R)-3-[[(2R)-2-methylpiperidin-1-yl]methyl]piperidin-1-yl]-[(3R)-pyrrolidin-3-yl]methanone
CID 125120891

Frequently Asked Questions

What is the IUPAC name of [(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride?
The IUPAC name of [(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride (CID 131163040) is [(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride.
What is the SMILES notation for [(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride?
The canonical SMILES for [(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride is Cl.N[C@@H]1CCCN(C(=O)C2CCNC2)C1.
What is the InChIKey of [(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride?
The InChIKey is MDDGQAFFATXNLF-ICLMXVQUSA-N. The full InChI is InChI=1S/C10H19N3O.ClH/c11-9-2-1-5-13(7-9)10(14)8-3-4-12-6-8;/h8-9,12H,1-7,11H2;1H/t8?,9-;/m1./s1.
What are the key properties of [(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride?
[(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride has a molecular weight of 233.74 g/mol, XLogP of -0.03, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-aminopiperidin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride is sourced from PubChem (CID 131163040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).