4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine

C25H23FN2O — CID 134467375

IUPAC4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine
SMILESFc1ccc(C(c2c(-c3ccccc3)[nH]c3ccccc23)N2CCOCC2)cc1
InChIInChI=1S/C25H23FN2O/c26-20-12-10-19(11-13-20)25(28-14-16-29-17-15-28)23-21-8-4-5-9-22(21)27-24(23)18-6-2-1-3-7-18/h1-13,25,27H,14-17H2
InChIKeyNCYYREUUBXQVPZ-UHFFFAOYSA-N
MW386.47 g/mol
LogP5.40
Rot. Bonds4

About 4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine

4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine (PubChem CID 134467375) has the molecular formula C25H23FN2O and a molecular weight of 386.47 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine
PubChem CID134467375
Molecular FormulaC25H23FN2O
Molecular Weight386.47 g/mol
Exact Mass386.18
IUPAC Name4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine
SMILESFc1ccc(C(c2c(-c3ccccc3)[nH]c3ccccc23)N2CCOCC2)cc1
InChIInChI=1S/C25H23FN2O/c26-20-12-10-19(11-13-20)25(28-14-16-29-17-15-28)23-21-8-4-5-9-22(21)27-24(23)18-6-2-1-3-7-18/h1-13,25,27H,14-17H2
InChIKeyNCYYREUUBXQVPZ-UHFFFAOYSA-N
XLogP5.40
TPSA28.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.47
LogP ≤ 55.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3-fluorophenyl)-(4-methylpiperazin-1-yl)methyl]-2-phenyl-1H-indole
CID 134467363
4-[bis(4-fluorophenyl)methyl]morpholine
CID 25146239
4-[(S)-(2-methyl-1H-indol-3-yl)-pyridin-4-ylmethyl]morpholine
CID 729468
2-[(4-fluorophenyl)-morpholin-4-ylmethyl]phenol
CID 102355502
4-[(S)-(2-methyl-1H-indol-3-yl)-thiophen-2-ylmethyl]morpholine
CID 696739
2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)acetic acid
CID 42651593
4-[1H-indol-3-yl(morpholin-4-yl)methyl]benzoic acid
CID 110453291
2-[morpholin-4-yl-(4-phenylphenyl)methyl]phenol
CID 102327495
4-[[1-[(R)-(4-fluorophenyl)-phenylmethyl]piperidin-4-yl]methyl]morpholine
CID 96522284
1-[(S)-morpholin-4-yl(phenyl)methyl]naphthalen-2-ol
CID 747708
4-[2-methyl-1-(2-methyl-1H-indol-3-yl)propyl]morpholine
CID 134844207
9H-carbazole;4-methylmorpholine
CID 175233361

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine?
The IUPAC name of 4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine (CID 134467375) is 4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine.
What is the SMILES notation for 4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine?
The canonical SMILES for 4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine is Fc1ccc(C(c2c(-c3ccccc3)[nH]c3ccccc23)N2CCOCC2)cc1.
What is the InChIKey of 4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine?
The InChIKey is NCYYREUUBXQVPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23FN2O/c26-20-12-10-19(11-13-20)25(28-14-16-29-17-15-28)23-21-8-4-5-9-22(21)27-24(23)18-6-2-1-3-7-18/h1-13,25,27H,14-17H2.
What are the key properties of 4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine?
4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine has a molecular weight of 386.47 g/mol, XLogP of 5.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)-(2-phenyl-1H-indol-3-yl)methyl]morpholine is sourced from PubChem (CID 134467375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).