2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine

C21H26N2O2 — CID 68541787

IUPAC2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine
SMILESc1ccc(C(Oc2ccccc2C2CCCC2)C2CNCCO2)nc1
InChIInChI=1S/C21H26N2O2/c1-2-8-16(7-1)17-9-3-4-11-19(17)25-21(18-10-5-6-12-23-18)20-15-22-13-14-24-20/h3-6,9-12,16,20-22H,1-2,7-8,13-15H2
InChIKeyDEJWZOSLBBDNRE-UHFFFAOYSA-N
MW338.45 g/mol
LogP3.85
Rot. Bonds5

About 2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine

2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine (PubChem CID 68541787) has the molecular formula C21H26N2O2 and a molecular weight of 338.45 g/mol. Its IUPAC name is 2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine.

Molecular Properties

Compound Name2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine
PubChem CID68541787
Molecular FormulaC21H26N2O2
Molecular Weight338.45 g/mol
Exact Mass338.20
IUPAC Name2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine
SMILESc1ccc(C(Oc2ccccc2C2CCCC2)C2CNCCO2)nc1
InChIInChI=1S/C21H26N2O2/c1-2-8-16(7-1)17-9-3-4-11-19(17)25-21(18-10-5-6-12-23-18)20-15-22-13-14-24-20/h3-6,9-12,16,20-22H,1-2,7-8,13-15H2
InChIKeyDEJWZOSLBBDNRE-UHFFFAOYSA-N
XLogP3.85
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-[(S)-(2-cyclohexylphenoxy)-phenylmethyl]morpholine
CID 59166998
(2S)-2-[pyridin-2-yl-[2-(trifluoromethyl)phenoxy]methyl]morpholine
CID 68546157
2-[(2,4-difluorophenoxy)-pyridin-2-ylmethyl]morpholine
CID 11594682
(2S)-2-[(S)-(2-phenylmethoxyphenoxy)-pyridin-2-ylmethyl]morpholine
CID 59166872
2-[(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine
CID 56667227
2-[(2-methoxy-3-pyridinyl)oxy-phenylmethyl]morpholine
CID 68541459
2-[(2-bromophenoxy)-(6-methoxy-2-pyridinyl)methyl]morpholine
CID 68544887
2-[(S)-(2-ethoxyphenoxy)-(1,3-oxazol-2-yl)methyl]morpholine
CID 68542656
(2R)-2-[(S)-(2-methylphenoxy)-phenylmethyl]morpholine
CID 45101528
2-[(S)-(2-ethoxyphenoxy)-piperidin-3-ylmethyl]pyridine
CID 68596518
2-[(2-ethoxyphenoxy)-pyridin-3-ylmethyl]morpholine
CID 11616643
(2R)-2-[(2-ethoxyphenoxy)-pyridin-3-ylmethyl]morpholine
CID 59166891

Frequently Asked Questions

What is the IUPAC name of 2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine?
The IUPAC name of 2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine (CID 68541787) is 2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine.
What is the SMILES notation for 2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine?
The canonical SMILES for 2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine is c1ccc(C(Oc2ccccc2C2CCCC2)C2CNCCO2)nc1.
What is the InChIKey of 2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine?
The InChIKey is DEJWZOSLBBDNRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O2/c1-2-8-16(7-1)17-9-3-4-11-19(17)25-21(18-10-5-6-12-23-18)20-15-22-13-14-24-20/h3-6,9-12,16,20-22H,1-2,7-8,13-15H2.
What are the key properties of 2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine?
2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine has a molecular weight of 338.45 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-cyclopentylphenoxy)-pyridin-2-ylmethyl]morpholine is sourced from PubChem (CID 68541787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).