2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol

C16H30N2O2 — CID 114339594

IUPAC2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol
SMILESCN1CCOC(CN2CCCC2C2CCCCC2O)C1
InChIInChI=1S/C16H30N2O2/c1-17-9-10-20-13(11-17)12-18-8-4-6-15(18)14-5-2-3-7-16(14)19/h13-16,19H,2-12H2,1H3
InChIKeyDWPCEFOWZJLVAG-UHFFFAOYSA-N
MW282.43 g/mol
LogP1.33
Rot. Bonds3

About 2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol

2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol (PubChem CID 114339594) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol
PubChem CID114339594
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol
SMILESCN1CCOC(CN2CCCC2C2CCCCC2O)C1
InChIInChI=1S/C16H30N2O2/c1-17-9-10-20-13(11-17)12-18-8-4-6-15(18)14-5-2-3-7-16(14)19/h13-16,19H,2-12H2,1H3
InChIKeyDWPCEFOWZJLVAG-UHFFFAOYSA-N
XLogP1.33
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol?
The IUPAC name of 2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol (CID 114339594) is 2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol.
What is the SMILES notation for 2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol?
The canonical SMILES for 2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol is CN1CCOC(CN2CCCC2C2CCCCC2O)C1.
What is the InChIKey of 2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol?
The InChIKey is DWPCEFOWZJLVAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-17-9-10-20-13(11-17)12-18-8-4-6-15(18)14-5-2-3-7-16(14)19/h13-16,19H,2-12H2,1H3.
What are the key properties of 2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol?
2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol has a molecular weight of 282.43 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol is sourced from PubChem (CID 114339594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).