[4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone

C14H20N2O2 — CID 60699283

IUPAC[4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone
SMILESCN(C)Cc1ccc(C(=O)N2CCOCC2)cc1
InChIInChI=1S/C14H20N2O2/c1-15(2)11-12-3-5-13(6-4-12)14(17)16-7-9-18-10-8-16/h3-6H,7-11H2,1-2H3
InChIKeyHRPMEEUMJSNKII-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.22
Rot. Bonds3

About [4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone

[4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone (PubChem CID 60699283) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is [4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone
PubChem CID60699283
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name[4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone
SMILESCN(C)Cc1ccc(C(=O)N2CCOCC2)cc1
InChIInChI=1S/C14H20N2O2/c1-15(2)11-12-3-5-13(6-4-12)14(17)16-7-9-18-10-8-16/h3-6H,7-11H2,1-2H3
InChIKeyHRPMEEUMJSNKII-UHFFFAOYSA-N
XLogP1.22
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(hydroxymethyl)phenyl]-morpholin-4-ylmethanone
CID 60635795
[4-(2,2-dimethylpropyl)phenyl]-morpholin-4-ylmethanone
CID 58674996
N,4-dimethyl-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]benzenesulfonamide
CID 53278764
N-benzyl-N-methyl-4-(morpholine-4-carbonyl)benzenesulfonamide
CID 37476685
(2R)-4-[4-[(dimethylamino)methyl]benzoyl]-2-methylmorpholine-2-carboxamide
CID 95838161
2-[benzyl(methyl)amino]-N-[[4-(morpholine-4-carbonyl)phenyl]methyl]acetamide
CID 32726719
3-[4-(morpholine-4-carbonyl)phenyl]propanoic acid
CID 28760123
ethane;(4-methylphenyl)-morpholin-4-ylmethanone;propane
CID 176553137
[4-(chloromethyl)phenyl]-(1,4-oxazepan-4-yl)methanone
CID 62986957
N-[3-(dimethylamino)propyl]-4-(morpholine-4-carbonyl)benzamide
CID 109045407
4-[4-[(dimethylamino)methyl]benzoyl]piperazin-2-one
CID 62734574
[4-[(dimethylamino)methyl]phenyl]-[4-(pyridin-4-ylmethyl)piperidin-1-yl]methanone
CID 110102879

Frequently Asked Questions

What is the IUPAC name of [4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone?
The IUPAC name of [4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone (CID 60699283) is [4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone?
The canonical SMILES for [4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone is CN(C)Cc1ccc(C(=O)N2CCOCC2)cc1.
What is the InChIKey of [4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone?
The InChIKey is HRPMEEUMJSNKII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-15(2)11-12-3-5-13(6-4-12)14(17)16-7-9-18-10-8-16/h3-6H,7-11H2,1-2H3.
What are the key properties of [4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone?
[4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone has a molecular weight of 248.33 g/mol, XLogP of 1.22, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 60699283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).