3'-cyclopentylspiro[adamantane-2,4'-piperidine]

C19H31N — CID 115927123

IUPAC3'-cyclopentylspiro[adamantane-2,4'-piperidine]
SMILESC1CCC(C2CNCCC23C2CC4CC(C2)CC3C4)C1
InChIInChI=1S/C19H31N/c1-2-4-15(3-1)18-12-20-6-5-19(18)16-8-13-7-14(10-16)11-17(19)9-13/h13-18,20H,1-12H2
InChIKeySUIJYLMWVVVNEV-UHFFFAOYSA-N
MW273.46 g/mol
LogP4.23
Rot. Bonds1

About 3'-cyclopentylspiro[adamantane-2,4'-piperidine]

3'-cyclopentylspiro[adamantane-2,4'-piperidine] (PubChem CID 115927123) has the molecular formula C19H31N and a molecular weight of 273.46 g/mol. Its IUPAC name is 3'-cyclopentylspiro[adamantane-2,4'-piperidine].

Molecular Properties

Compound Name3'-cyclopentylspiro[adamantane-2,4'-piperidine]
PubChem CID115927123
Molecular FormulaC19H31N
Molecular Weight273.46 g/mol
Exact Mass273.25
IUPAC Name3'-cyclopentylspiro[adamantane-2,4'-piperidine]
SMILESC1CCC(C2CNCCC23C2CC4CC(C2)CC3C4)C1
InChIInChI=1S/C19H31N/c1-2-4-15(3-1)18-12-20-6-5-19(18)16-8-13-7-14(10-16)11-17(19)9-13/h13-18,20H,1-12H2
InChIKeySUIJYLMWVVVNEV-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.46
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-cyclopentyl-3-azaspiro[5.6]dodecane
CID 112570787
3-cyclohexyl-4-fluoro-4-methylpiperidine
CID 84721139
3-cycloheptyl-4-fluoro-4-methylpiperidine
CID 84723549
11-cyclopentyl-3-oxa-9-azaspiro[5.5]undecane
CID 112570802
3-cyclopentyl-4-methyl-4-propan-2-ylpiperidine
CID 112570765
3-cyclobutyl-4-fluoro-4-methylpiperidine
CID 84717415
11-cyclopentyl-3-ethyl-3,9-diazaspiro[5.5]undecane
CID 112570790
5-cyclopentyl-9-propan-2-yl-3-azaspiro[5.5]undecane
CID 112570873
9-tert-butyl-5-cyclopentyl-3-azaspiro[5.5]undecane
CID 115927129
6-cyclopentyl-2λ6-thia-8-azaspiro[4.5]decane 2,2-dioxide
CID 112570757
2-cyclopentyl-5-azaspiro[2.4]heptane
CID 115013095
3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine
CID 112570898

Frequently Asked Questions

What is the IUPAC name of 3'-cyclopentylspiro[adamantane-2,4'-piperidine]?
The IUPAC name of 3'-cyclopentylspiro[adamantane-2,4'-piperidine] (CID 115927123) is 3'-cyclopentylspiro[adamantane-2,4'-piperidine].
What is the SMILES notation for 3'-cyclopentylspiro[adamantane-2,4'-piperidine]?
The canonical SMILES for 3'-cyclopentylspiro[adamantane-2,4'-piperidine] is C1CCC(C2CNCCC23C2CC4CC(C2)CC3C4)C1.
What is the InChIKey of 3'-cyclopentylspiro[adamantane-2,4'-piperidine]?
The InChIKey is SUIJYLMWVVVNEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N/c1-2-4-15(3-1)18-12-20-6-5-19(18)16-8-13-7-14(10-16)11-17(19)9-13/h13-18,20H,1-12H2.
What are the key properties of 3'-cyclopentylspiro[adamantane-2,4'-piperidine]?
3'-cyclopentylspiro[adamantane-2,4'-piperidine] has a molecular weight of 273.46 g/mol, XLogP of 4.23, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3'-cyclopentylspiro[adamantane-2,4'-piperidine] is sourced from PubChem (CID 115927123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).