3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine

C16H31NO — CID 112570898

IUPAC3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine
SMILESCOC(C)(C)CC1(C)CCNCC1C1CCCC1
InChIInChI=1S/C16H31NO/c1-15(2,18-4)12-16(3)9-10-17-11-14(16)13-7-5-6-8-13/h13-14,17H,5-12H2,1-4H3
InChIKeyGGYUWZZBUCGUPC-UHFFFAOYSA-N
MW253.43 g/mol
LogP3.61
Rot. Bonds4

About 3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine

3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine (PubChem CID 112570898) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is 3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine.

Molecular Properties

Compound Name3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine
PubChem CID112570898
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC Name3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine
SMILESCOC(C)(C)CC1(C)CCNCC1C1CCCC1
InChIInChI=1S/C16H31NO/c1-15(2,18-4)12-16(3)9-10-17-11-14(16)13-7-5-6-8-13/h13-14,17H,5-12H2,1-4H3
InChIKeyGGYUWZZBUCGUPC-UHFFFAOYSA-N
XLogP3.61
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-methoxy-2-methylpropyl)-4-methyl-3-propan-2-ylpiperidine
CID 79321513
9-tert-butyl-5-cyclopentyl-3-azaspiro[5.5]undecane
CID 115927129
3-cyclohexyl-4-fluoro-4-methylpiperidine
CID 84721139
3-cycloheptyl-4-fluoro-4-methylpiperidine
CID 84723549
3-cyclopentyl-4-methyl-4-propan-2-ylpiperidine
CID 112570765
3-cyclobutyl-4-fluoro-4-methylpiperidine
CID 84717415
5-cyclopentyl-9-propan-2-yl-3-azaspiro[5.5]undecane
CID 112570873
5-cyclopentyl-3-azaspiro[5.6]dodecane
CID 112570787
11-cyclopentyl-3-ethyl-3,9-diazaspiro[5.5]undecane
CID 112570790
11-cyclopentyl-3-oxa-9-azaspiro[5.5]undecane
CID 112570802
3'-cyclopentylspiro[adamantane-2,4'-piperidine]
CID 115927123
(3,3-dimethoxy-2-piperidin-3-ylbutan-2-yl)silane
CID 174882901

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine?
The IUPAC name of 3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine (CID 112570898) is 3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine.
What is the SMILES notation for 3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine?
The canonical SMILES for 3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine is COC(C)(C)CC1(C)CCNCC1C1CCCC1.
What is the InChIKey of 3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine?
The InChIKey is GGYUWZZBUCGUPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO/c1-15(2,18-4)12-16(3)9-10-17-11-14(16)13-7-5-6-8-13/h13-14,17H,5-12H2,1-4H3.
What are the key properties of 3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine?
3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine has a molecular weight of 253.43 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-4-(2-methoxy-2-methylpropyl)-4-methylpiperidine is sourced from PubChem (CID 112570898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).