1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride

C11H19ClN2O — CID 130643737

IUPAC1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride
SMILESCl.O=C(C1CCCN1)N1CCC12CCC2
InChIInChI=1S/C11H18N2O.ClH/c14-10(9-3-1-7-12-9)13-8-6-11(13)4-2-5-11;/h9,12H,1-8H2;1H
InChIKeyJUGAZUFPYNNBSN-UHFFFAOYSA-N
MW230.74 g/mol
LogP1.32
Rot. Bonds1

About 1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride

1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride (PubChem CID 130643737) has the molecular formula C11H19ClN2O and a molecular weight of 230.74 g/mol. Its IUPAC name is 1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride.

Molecular Properties

Compound Name1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride
PubChem CID130643737
Molecular FormulaC11H19ClN2O
Molecular Weight230.74 g/mol
Exact Mass230.12
IUPAC Name1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride
SMILESCl.O=C(C1CCCN1)N1CCC12CCC2
InChIInChI=1S/C11H18N2O.ClH/c14-10(9-3-1-7-12-9)13-8-6-11(13)4-2-5-11;/h9,12H,1-8H2;1H
InChIKeyJUGAZUFPYNNBSN-UHFFFAOYSA-N
XLogP1.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.74
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-1-[(2R)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
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CID 70226486
pyrrolidin-1-yl(pyrrolidin-2-yl)methanone
CID 550904
4-[(2S)-pyrrolidine-2-carbonyl]piperazine-1-carbaldehyde;hydrochloride
CID 175528079
(3,3-difluoropyrrolidin-1-yl)-pyrrolidin-2-ylmethanone;hydrochloride
CID 135306349
(4-methylpiperazin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone;dihydrochloride
CID 165429624
cyclopropyl-[4-[(2S)-pyrrolidine-2-carbonyl]piperazin-1-yl]methanone;hydrochloride
CID 71888790
(4,4-dimethylpiperidin-1-yl)-piperidin-2-ylmethanone;hydrochloride
CID 119316184
(2R)-2-nitro-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
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[(2S)-pyrrolidin-2-yl]-thiomorpholin-4-ylmethanone;hydrochloride
CID 66548475
[(2R)-azetidin-2-yl]-(2,2-dimethylpyrrolidin-1-yl)methanone
CID 130719344
(4,4-dimethylazepan-1-yl)-[(2R)-pyrrolidin-2-yl]methanone
CID 103797741

Frequently Asked Questions

What is the IUPAC name of 1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride?
The IUPAC name of 1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride (CID 130643737) is 1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride.
What is the SMILES notation for 1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride?
The canonical SMILES for 1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride is Cl.O=C(C1CCCN1)N1CCC12CCC2.
What is the InChIKey of 1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride?
The InChIKey is JUGAZUFPYNNBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O.ClH/c14-10(9-3-1-7-12-9)13-8-6-11(13)4-2-5-11;/h9,12H,1-8H2;1H.
What are the key properties of 1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride?
1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride has a molecular weight of 230.74 g/mol, XLogP of 1.32, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-azaspiro[3.3]heptan-1-yl(pyrrolidin-2-yl)methanone;hydrochloride is sourced from PubChem (CID 130643737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).