trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol

C11H21NO — CID 122235783

IUPACtrans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol
SMILESCC1(C)CCC1N[C@@H]1CCC[C@H]1O
InChIInChI=1S/C11H21NO/c1-11(2)7-6-10(11)12-8-4-3-5-9(8)13/h8-10,12-13H,3-7H2,1-2H3/t8-,9-,10?/m1/s1
InChIKeyWOMRIXFIISVZQB-MGRQHWMJSA-N
MW183.29 g/mol
LogP1.68
Rot. Bonds2

About trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol

trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol (PubChem CID 122235783) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol
PubChem CID122235783
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Nametrans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol
SMILESCC1(C)CCC1N[C@@H]1CCC[C@H]1O
InChIInChI=1S/C11H21NO/c1-11(2)7-6-10(11)12-8-4-3-5-9(8)13/h8-10,12-13H,3-7H2,1-2H3/t8-,9-,10?/m1/s1
InChIKeyWOMRIXFIISVZQB-MGRQHWMJSA-N
XLogP1.68
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol?
The IUPAC name of trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol (CID 122235783) is trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol.
What is the SMILES notation for trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol?
The canonical SMILES for trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol is CC1(C)CCC1N[C@@H]1CCC[C@H]1O.
What is the InChIKey of trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol?
The InChIKey is WOMRIXFIISVZQB-MGRQHWMJSA-N. The full InChI is InChI=1S/C11H21NO/c1-11(2)7-6-10(11)12-8-4-3-5-9(8)13/h8-10,12-13H,3-7H2,1-2H3/t8-,9-,10?/m1/s1.
What are the key properties of trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol?
trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol has a molecular weight of 183.29 g/mol, XLogP of 1.68, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-[(2,2-dimethylcyclobutyl)amino]cyclopentan-1-ol is sourced from PubChem (CID 122235783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).