4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine

C19H21N3O — CID 155405830

IUPAC4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine
SMILESc1ccc(-c2ccc(C3CN(C4=NCCN4)CCO3)cc2)cc1
InChIInChI=1S/C19H21N3O/c1-2-4-15(5-3-1)16-6-8-17(9-7-16)18-14-22(12-13-23-18)19-20-10-11-21-19/h1-9,18H,10-14H2,(H,20,21)
InChIKeyIGBNPLAUZKAFGU-UHFFFAOYSA-N
MW307.40 g/mol
LogP2.69
Rot. Bonds2

About 4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine

4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine (PubChem CID 155405830) has the molecular formula C19H21N3O and a molecular weight of 307.40 g/mol. Its IUPAC name is 4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine.

Molecular Properties

Compound Name4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine
PubChem CID155405830
Molecular FormulaC19H21N3O
Molecular Weight307.40 g/mol
Exact Mass307.17
IUPAC Name4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine
SMILESc1ccc(-c2ccc(C3CN(C4=NCCN4)CCO3)cc2)cc1
InChIInChI=1S/C19H21N3O/c1-2-4-15(5-3-1)16-6-8-17(9-7-16)18-14-22(12-13-23-18)19-20-10-11-21-19/h1-9,18H,10-14H2,(H,20,21)
InChIKeyIGBNPLAUZKAFGU-UHFFFAOYSA-N
XLogP2.69
TPSA36.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine?
The IUPAC name of 4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine (CID 155405830) is 4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine.
What is the SMILES notation for 4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine?
The canonical SMILES for 4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine is c1ccc(-c2ccc(C3CN(C4=NCCN4)CCO3)cc2)cc1.
What is the InChIKey of 4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine?
The InChIKey is IGBNPLAUZKAFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O/c1-2-4-15(5-3-1)16-6-8-17(9-7-16)18-14-22(12-13-23-18)19-20-10-11-21-19/h1-9,18H,10-14H2,(H,20,21).
What are the key properties of 4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine?
4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine has a molecular weight of 307.40 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5-dihydro-1H-imidazol-2-yl)-2-(4-phenylphenyl)morpholine is sourced from PubChem (CID 155405830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).