2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol

C16H30N2O — CID 83997337

IUPAC2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol
SMILESOCCC1CC(NCC2CCC2)CN(C2CCC2)C1
InChIInChI=1S/C16H30N2O/c19-8-7-14-9-15(17-10-13-3-1-4-13)12-18(11-14)16-5-2-6-16/h13-17,19H,1-12H2
InChIKeyOMYJADVUZPRTPJ-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.00
Rot. Bonds6

About 2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol

2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol (PubChem CID 83997337) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol
PubChem CID83997337
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol
SMILESOCCC1CC(NCC2CCC2)CN(C2CCC2)C1
InChIInChI=1S/C16H30N2O/c19-8-7-14-9-15(17-10-13-3-1-4-13)12-18(11-14)16-5-2-6-16/h13-17,19H,1-12H2
InChIKeyOMYJADVUZPRTPJ-UHFFFAOYSA-N
XLogP2.00
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-Methyl-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992066
2-[1-Ethyl-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992105
2-[1-Propyl-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992136
2-[1-(2-Methylpropyl)-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992160
2-[1-Butyl-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992175
2-[1-Propan-2-yl-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992213
2-[1-Butan-2-yl-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992430
2-[1-Cyclobutyl-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992494
2-[1-(3-Methylcyclobutyl)-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992508
2-[1-(2-Methylcyclobutyl)-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992518
2-[1-(1-Cyclobutylethyl)-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992571
2-[1-(Cyclobutylmethyl)-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992581

Frequently Asked Questions

What is the IUPAC name of 2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol?
The IUPAC name of 2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol (CID 83997337) is 2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol?
The canonical SMILES for 2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol is OCCC1CC(NCC2CCC2)CN(C2CCC2)C1.
What is the InChIKey of 2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol?
The InChIKey is OMYJADVUZPRTPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c19-8-7-14-9-15(17-10-13-3-1-4-13)12-18(11-14)16-5-2-6-16/h13-17,19H,1-12H2.
What are the key properties of 2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol?
2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol has a molecular weight of 266.43 g/mol, XLogP of 2.00, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol is sourced from PubChem (CID 83997337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).