1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone

C19H24N2O2 — CID 71785974

IUPAC1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone
SMILESCN(C)CC1COCCN1C(=O)Cc1cccc2ccccc12
InChIInChI=1S/C19H24N2O2/c1-20(2)13-17-14-23-11-10-21(17)19(22)12-16-8-5-7-15-6-3-4-9-18(15)16/h3-9,17H,10-14H2,1-2H3
InChIKeyHPSFZFSWUBBQNT-UHFFFAOYSA-N
MW312.41 g/mol
LogP2.17
Rot. Bonds4

About 1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone

1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone (PubChem CID 71785974) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone.

Molecular Properties

Compound Name1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone
PubChem CID71785974
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone
SMILESCN(C)CC1COCCN1C(=O)Cc1cccc2ccccc12
InChIInChI=1S/C19H24N2O2/c1-20(2)13-17-14-23-11-10-21(17)19(22)12-16-8-5-7-15-6-3-4-9-18(15)16/h3-9,17H,10-14H2,1-2H3
InChIKeyHPSFZFSWUBBQNT-UHFFFAOYSA-N
XLogP2.17
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone with MolForge

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Related Compounds

4-(2-naphthalen-1-ylacetyl)morpholine-3-carboxylic acid
CID 119216821
1-benzofuran-2-yl-[(3R)-3-[(dimethylamino)methyl]morpholin-4-yl]methanone
CID 97040394
1-[(3S)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]-2-phenylethanone
CID 97040365
1-[(3R)-3-[(dimethylamino)methyl]morpholin-4-yl]-2-ethoxyethanone
CID 97040273
1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-(2-fluorophenoxy)ethanone;formic acid
CID 71785953
1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-(4-methoxyphenoxy)ethanone;formic acid
CID 71785945
1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-(2-hydroxyphenyl)ethanone
CID 80740437
3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one
CID 136566373
1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-ethoxyethanone;formic acid
CID 71785884
2-[2-[(3R)-3-methylmorpholin-4-yl]-2-oxoethyl]benzoic acid
CID 106773928
cyclohexyl-[(3R)-3-[(dimethylamino)methyl]morpholin-4-yl]methanone
CID 97040260
1-[3-(methoxymethyl)morpholin-4-yl]-2-pyridin-2-ylethanone
CID 112537732

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone?
The IUPAC name of 1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone (CID 71785974) is 1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone.
What is the SMILES notation for 1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone?
The canonical SMILES for 1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone is CN(C)CC1COCCN1C(=O)Cc1cccc2ccccc12.
What is the InChIKey of 1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone?
The InChIKey is HPSFZFSWUBBQNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-20(2)13-17-14-23-11-10-21(17)19(22)12-16-8-5-7-15-6-3-4-9-18(15)16/h3-9,17H,10-14H2,1-2H3.
What are the key properties of 1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone?
1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone has a molecular weight of 312.41 g/mol, XLogP of 2.17, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-naphthalen-1-ylethanone is sourced from PubChem (CID 71785974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).