[4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone

C19H22N2O2 — CID 101130657

IUPAC[4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone
SMILESCN(C)c1ccc(C(=O)c2ccc(N3CCOCC3)cc2)cc1
InChIInChI=1S/C19H22N2O2/c1-20(2)17-7-3-15(4-8-17)19(22)16-5-9-18(10-6-16)21-11-13-23-14-12-21/h3-10H,11-14H2,1-2H3
InChIKeyJMISXHBYWWCNFO-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.82
Rot. Bonds4

About [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone

[4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone (PubChem CID 101130657) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone.

Molecular Properties

Compound Name[4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone
PubChem CID101130657
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name[4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone
SMILESCN(C)c1ccc(C(=O)c2ccc(N3CCOCC3)cc2)cc1
InChIInChI=1S/C19H22N2O2/c1-20(2)17-7-3-15(4-8-17)19(22)16-5-9-18(10-6-16)21-11-13-23-14-12-21/h3-10H,11-14H2,1-2H3
InChIKeyJMISXHBYWWCNFO-UHFFFAOYSA-N
XLogP2.82
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone?
The IUPAC name of [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone (CID 101130657) is [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone.
What is the SMILES notation for [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone?
The canonical SMILES for [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone is CN(C)c1ccc(C(=O)c2ccc(N3CCOCC3)cc2)cc1.
What is the InChIKey of [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone?
The InChIKey is JMISXHBYWWCNFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-20(2)17-7-3-15(4-8-17)19(22)16-5-9-18(10-6-16)21-11-13-23-14-12-21/h3-10H,11-14H2,1-2H3.
What are the key properties of [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone?
[4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone has a molecular weight of 310.40 g/mol, XLogP of 2.82, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone is sourced from PubChem (CID 101130657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).