cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol

C11H21NO — CID 101409360

IUPACcis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol
SMILESC[C@@]1(O)CCCC[C@H]1N1CCCC1
InChIInChI=1S/C11H21NO/c1-11(13)7-3-2-6-10(11)12-8-4-5-9-12/h10,13H,2-9H2,1H3/t10-,11-/m1/s1
InChIKeyFDHLZVXRCXDFNT-GHMZBOCLSA-N
MW183.29 g/mol
LogP1.78
Rot. Bonds1

About cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol

cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol (PubChem CID 101409360) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol.

Molecular Properties

Compound Namecis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol
PubChem CID101409360
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Namecis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol
SMILESC[C@@]1(O)CCCC[C@H]1N1CCCC1
InChIInChI=1S/C11H21NO/c1-11(13)7-3-2-6-10(11)12-8-4-5-9-12/h10,13H,2-9H2,1H3/t10-,11-/m1/s1
InChIKeyFDHLZVXRCXDFNT-GHMZBOCLSA-N
XLogP1.78
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol?
The IUPAC name of cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol (CID 101409360) is cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol.
What is the SMILES notation for cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol?
The canonical SMILES for cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol is C[C@@]1(O)CCCC[C@H]1N1CCCC1.
What is the InChIKey of cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol?
The InChIKey is FDHLZVXRCXDFNT-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H21NO/c1-11(13)7-3-2-6-10(11)12-8-4-5-9-12/h10,13H,2-9H2,1H3/t10-,11-/m1/s1.
What are the key properties of cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol?
cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol has a molecular weight of 183.29 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol is sourced from PubChem (CID 101409360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).