(2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine

C19H28N2O3 — CID 97147456

IUPAC(2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine
SMILESc1ccc(N2CCOCC2)c(CN2CCO[C@@H]([C@@H]3CCCO3)C2)c1
InChIInChI=1S/C19H28N2O3/c1-2-5-17(21-8-11-22-12-9-21)16(4-1)14-20-7-13-24-19(15-20)18-6-3-10-23-18/h1-2,4-5,18-19H,3,6-15H2/t18-,19+/m0/s1
InChIKeyGHUREAPQKQYROM-RBUKOAKNSA-N
MW332.44 g/mol
LogP1.90
Rot. Bonds4

About (2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine

(2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine (PubChem CID 97147456) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is (2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine.

Molecular Properties

Compound Name(2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine
PubChem CID97147456
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC Name(2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine
SMILESc1ccc(N2CCOCC2)c(CN2CCO[C@@H]([C@@H]3CCCO3)C2)c1
InChIInChI=1S/C19H28N2O3/c1-2-5-17(21-8-11-22-12-9-21)16(4-1)14-20-7-13-24-19(15-20)18-6-3-10-23-18/h1-2,4-5,18-19H,3,6-15H2/t18-,19+/m0/s1
InChIKeyGHUREAPQKQYROM-RBUKOAKNSA-N
XLogP1.90
TPSA34.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine with MolForge

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Related Compounds

2-[4-(hydroxymethyl)-1-[(2-morpholin-4-ylphenyl)methyl]pyrrolidin-3-yl]ethanol
CID 167884756
4-[2-[(4-methylpiperazin-1-yl)methyl]phenyl]morpholine
CID 167847529
(2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine
CID 124830182
(2R)-4-[(5-bromofuran-2-yl)methyl]-2-[(2S)-oxolan-2-yl]morpholine
CID 99832542
(2S)-4-[(5-bromofuran-2-yl)methyl]-2-[(2S)-oxolan-2-yl]morpholine
CID 99832541
(2S)-4-[(2-methyl-3-phenylimidazol-4-yl)methyl]-2-[(2S)-oxolan-2-yl]morpholine
CID 97147443
2-[1-[(2-morpholin-4-ylphenyl)methyl]piperidin-4-yl]hexanoic acid;dihydrochloride
CID 142749275
4-[2-[[3-(5-methyl-1,2-oxazol-3-yl)azetidin-1-yl]methyl]phenyl]morpholine
CID 166290301
4-[(2-morpholin-4-ylphenyl)methylamino]cyclohexan-1-ol
CID 110928598
[1-[(2-morpholin-4-ylphenyl)methyl]-5-oxopyrrolidin-3-yl]methanesulfonyl fluoride
CID 168676614
[4-[(4-bromo-2-morpholin-4-ylphenyl)methyl]morpholin-2-yl]methanamine
CID 120844485
4-benzyl-2-piperidin-2-ylmorpholine
CID 82380108

Frequently Asked Questions

What is the IUPAC name of (2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine?
The IUPAC name of (2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine (CID 97147456) is (2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine.
What is the SMILES notation for (2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine?
The canonical SMILES for (2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine is c1ccc(N2CCOCC2)c(CN2CCO[C@@H]([C@@H]3CCCO3)C2)c1.
What is the InChIKey of (2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine?
The InChIKey is GHUREAPQKQYROM-RBUKOAKNSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-2-5-17(21-8-11-22-12-9-21)16(4-1)14-20-7-13-24-19(15-20)18-6-3-10-23-18/h1-2,4-5,18-19H,3,6-15H2/t18-,19+/m0/s1.
What are the key properties of (2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine?
(2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine has a molecular weight of 332.44 g/mol, XLogP of 1.90, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine is sourced from PubChem (CID 97147456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).