[2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone

C19H21NO3 — CID 21264591

IUPAC[2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone
SMILESCc1ccccc1OCc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C19H21NO3/c1-15-6-2-5-9-18(15)23-14-16-7-3-4-8-17(16)19(21)20-10-12-22-13-11-20/h2-9H,10-14H2,1H3
InChIKeyZLEXIARWHROKEJ-UHFFFAOYSA-N
MW311.38 g/mol
LogP3.05
Rot. Bonds4

About [2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone

[2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone (PubChem CID 21264591) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is [2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone
PubChem CID21264591
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name[2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone
SMILESCc1ccccc1OCc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C19H21NO3/c1-15-6-2-5-9-18(15)23-14-16-7-3-4-8-17(16)19(21)20-10-12-22-13-11-20/h2-9H,10-14H2,1H3
InChIKeyZLEXIARWHROKEJ-UHFFFAOYSA-N
XLogP3.05
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[(2-methylphenoxy)methyl]benzoate
CID 11043352
(3-hydroxypiperidin-1-yl)-[2-[(2-methylphenyl)methoxy]phenyl]methanone
CID 110883794
4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]benzonitrile
CID 17465828
ethyl 2-(1,4,7-trioxa-10-azacyclododecane-10-carbonyl)benzoate
CID 15945097
[3-(hydroxymethyl)piperidin-1-yl]-[2-[(2-methylphenyl)methoxy]phenyl]methanone
CID 110886796
(2-methoxy-6-methylphenyl)-morpholin-4-ylmethanone
CID 131909764
[2-(phenoxymethyl)phenyl]-pyrrolidin-1-ylmethanone
CID 78774462
[2-(morpholine-4-carbonyl)phenyl] N,N-dimethylcarbamate
CID 122368109
1-[4-(2-chlorobenzoyl)piperazin-1-yl]-2-(2-methylphenoxy)ethanone
CID 39712313
2-[(2-methylphenyl)methoxy]benzamide
CID 7642222
N-methyl-2-[2-[(2-methylphenoxy)methyl]phenyl]but-2-enamide
CID 54096799
[2-[(2-methylphenoxy)methyl]phenyl]-pyridin-2-ylmethanone
CID 21264597

Frequently Asked Questions

What is the IUPAC name of [2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone?
The IUPAC name of [2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone (CID 21264591) is [2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone?
The canonical SMILES for [2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone is Cc1ccccc1OCc1ccccc1C(=O)N1CCOCC1.
What is the InChIKey of [2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone?
The InChIKey is ZLEXIARWHROKEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO3/c1-15-6-2-5-9-18(15)23-14-16-7-3-4-8-17(16)19(21)20-10-12-22-13-11-20/h2-9H,10-14H2,1H3.
What are the key properties of [2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone?
[2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone has a molecular weight of 311.38 g/mol, XLogP of 3.05, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-methylphenoxy)methyl]phenyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 21264591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).