2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine

C14H19BrFNO — CID 82970407

IUPAC2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine
SMILESCC(C)CC1COC(c2ccc(Br)cc2F)CN1
InChIInChI=1S/C14H19BrFNO/c1-9(2)5-11-8-18-14(7-17-11)12-4-3-10(15)6-13(12)16/h3-4,6,9,11,14,17H,5,7-8H2,1-2H3
InChIKeyYUVFLMWDTUXDDN-UHFFFAOYSA-N
MW316.21 g/mol
LogP3.66
Rot. Bonds3

About 2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine

2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine (PubChem CID 82970407) has the molecular formula C14H19BrFNO and a molecular weight of 316.21 g/mol. Its IUPAC name is 2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine.

Molecular Properties

Compound Name2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine
PubChem CID82970407
Molecular FormulaC14H19BrFNO
Molecular Weight316.21 g/mol
Exact Mass315.06
IUPAC Name2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine
SMILESCC(C)CC1COC(c2ccc(Br)cc2F)CN1
InChIInChI=1S/C14H19BrFNO/c1-9(2)5-11-8-18-14(7-17-11)12-4-3-10(15)6-13(12)16/h3-4,6,9,11,14,17H,5,7-8H2,1-2H3
InChIKeyYUVFLMWDTUXDDN-UHFFFAOYSA-N
XLogP3.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.21
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3,4-difluorophenyl)-5-(2-methylpropyl)morpholine
CID 61251730
5-(2-methylpropyl)-2-[2-(trifluoromethyl)phenyl]morpholine
CID 61251439
5-(2-methylpropyl)-2-[4-(trifluoromethyl)phenyl]morpholine
CID 61250695
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(2-methylpropyl)morpholine
CID 61251441
5-(2-methylpropyl)-2-[4-(trifluoromethoxy)phenyl]morpholine
CID 61250917
2-(4-bromo-2-fluorophenyl)-5,7-dimethyl-1,4-oxazepane
CID 113376488
2-(5-bromo-2-fluorophenyl)-5,6-dimethyl-1,4-oxazepane
CID 113484913
2-(3-chloro-4-fluorophenyl)-5-ethylmorpholine
CID 43366861
(3S)-3-(4-bromo-2-fluorophenyl)morpholine
CID 130618619
N-[[2-(4-bromo-2-fluorophenyl)oxolan-3-yl]methyl]-2-methylpropan-1-amine
CID 79365705
1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine
CID 64946822
4-(4-bromo-2-fluorophenyl)-3-propan-2-ylpiperidine
CID 79320340

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine?
The IUPAC name of 2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine (CID 82970407) is 2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine.
What is the SMILES notation for 2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine?
The canonical SMILES for 2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine is CC(C)CC1COC(c2ccc(Br)cc2F)CN1.
What is the InChIKey of 2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine?
The InChIKey is YUVFLMWDTUXDDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrFNO/c1-9(2)5-11-8-18-14(7-17-11)12-4-3-10(15)6-13(12)16/h3-4,6,9,11,14,17H,5,7-8H2,1-2H3.
What are the key properties of 2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine?
2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine has a molecular weight of 316.21 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-fluorophenyl)-5-(2-methylpropyl)morpholine is sourced from PubChem (CID 82970407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).