3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine

C18H32N2 — CID 102952491

IUPAC3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine
SMILESC1CCC2(CC1)CCC2N1CCCC(C2CCCN2)C1
InChIInChI=1S/C18H32N2/c1-2-9-18(10-3-1)11-8-17(18)20-13-5-6-15(14-20)16-7-4-12-19-16/h15-17,19H,1-14H2
InChIKeyBNHZBGZMTHHOOE-UHFFFAOYSA-N
MW276.47 g/mol
LogP3.56
Rot. Bonds2

About 3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine

3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine (PubChem CID 102952491) has the molecular formula C18H32N2 and a molecular weight of 276.47 g/mol. Its IUPAC name is 3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine.

Molecular Properties

Compound Name3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine
PubChem CID102952491
Molecular FormulaC18H32N2
Molecular Weight276.47 g/mol
Exact Mass276.26
IUPAC Name3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine
SMILESC1CCC2(CC1)CCC2N1CCCC(C2CCCN2)C1
InChIInChI=1S/C18H32N2/c1-2-9-18(10-3-1)11-8-17(18)20-13-5-6-15(14-20)16-7-4-12-19-16/h15-17,19H,1-14H2
InChIKeyBNHZBGZMTHHOOE-UHFFFAOYSA-N
XLogP3.56
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.47
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpyrrolidine
CID 102952516
1-[(3-pyrrolidin-2-ylpiperidin-1-yl)methyl]cyclohexan-1-ol
CID 65213918
1-(1-methylpyrrolidin-3-yl)-3-pyrrolidin-2-ylpiperidine
CID 62977717
6-cycloheptyl-2,3,4,4a,5,7,8,8a-octahydro-1H-1,6-naphthyridine
CID 82931358
1,2,3,4,4a,5,7,8,9,9a,10,10a-dodecahydropyrrolo[1,2-g][1,6]naphthyridine
CID 112714709
(4aS,7aS)-6-(2,2-dimethylcyclohexyl)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102678939
2-cyclodecylazecane
CID 126739440
(2S)-2-cyclohexylpiperidine
CID 7016471
6-(2,2-dimethylcyclopentyl)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102678540
6-(1,2,3,5,6,7,8,8a-octahydroindolizin-7-yl)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102678482
2-cycloheptylpyrrolidine;hydrochloride
CID 115023231
2-cycloheptylpiperidine;hydrochloride
CID 115030388

Frequently Asked Questions

What is the IUPAC name of 3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine?
The IUPAC name of 3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine (CID 102952491) is 3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine.
What is the SMILES notation for 3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine?
The canonical SMILES for 3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine is C1CCC2(CC1)CCC2N1CCCC(C2CCCN2)C1.
What is the InChIKey of 3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine?
The InChIKey is BNHZBGZMTHHOOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2/c1-2-9-18(10-3-1)11-8-17(18)20-13-5-6-15(14-20)16-7-4-12-19-16/h15-17,19H,1-14H2.
What are the key properties of 3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine?
3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine has a molecular weight of 276.47 g/mol, XLogP of 3.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrrolidin-2-yl-1-spiro[3.5]nonan-3-ylpiperidine is sourced from PubChem (CID 102952491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).