(3R)-3-(5-bromo-2-methylphenyl)morpholine

C11H14BrNO — CID 130632472

IUPAC(3R)-3-(5-bromo-2-methylphenyl)morpholine
SMILESCc1ccc(Br)cc1[C@@H]1COCCN1
InChIInChI=1S/C11H14BrNO/c1-8-2-3-9(12)6-10(8)11-7-14-5-4-13-11/h2-3,6,11,13H,4-5,7H2,1H3/t11-/m0/s1
InChIKeyHSYYNBCYFTWKLU-NSHDSACASA-N
MW256.14 g/mol
LogP2.42
Rot. Bonds1

About (3R)-3-(5-bromo-2-methylphenyl)morpholine

(3R)-3-(5-bromo-2-methylphenyl)morpholine (PubChem CID 130632472) has the molecular formula C11H14BrNO and a molecular weight of 256.14 g/mol. Its IUPAC name is (3R)-3-(5-bromo-2-methylphenyl)morpholine.

Molecular Properties

Compound Name(3R)-3-(5-bromo-2-methylphenyl)morpholine
PubChem CID130632472
Molecular FormulaC11H14BrNO
Molecular Weight256.14 g/mol
Exact Mass255.03
IUPAC Name(3R)-3-(5-bromo-2-methylphenyl)morpholine
SMILESCc1ccc(Br)cc1[C@@H]1COCCN1
InChIInChI=1S/C11H14BrNO/c1-8-2-3-9(12)6-10(8)11-7-14-5-4-13-11/h2-3,6,11,13H,4-5,7H2,1H3/t11-/m0/s1
InChIKeyHSYYNBCYFTWKLU-NSHDSACASA-N
XLogP2.42
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.14
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3R)-3-(5-bromo-2-methylphenyl)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

(3S)-3-(2-methyl-5-propan-2-ylphenyl)morpholine
CID 96844502
(3S)-3-(4-bromo-2-fluorophenyl)morpholine
CID 130618619
(3R)-3-(4-bromo-2-methoxyphenyl)morpholine;hydrochloride
CID 171192624
(3S)-3-(2-bromo-4-methylphenyl)morpholine;hydrochloride
CID 171193090
5-bromo-2-[(3S)-morpholin-3-yl]benzoic acid
CID 131436603
3-(4-chloro-2,5-dimethylphenyl)morpholine
CID 84790642
3-(6-bromonaphthalen-2-yl)morpholine
CID 175413265
(3S)-3-(3,4-dimethylphenyl)morpholine;hydrochloride
CID 171193047
2,4-dibromo-6-[(3R)-morpholin-3-yl]phenol;hydrochloride
CID 171192443
4-methyl-6-morpholin-3-ylbenzene-1,3-diol
CID 84780563
3-(3-bromophenyl)morpholine;hydrochloride
CID 122156777
3-bromo-6-methyl-2-morpholin-3-ylphenol
CID 84809565

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(5-bromo-2-methylphenyl)morpholine?
The IUPAC name of (3R)-3-(5-bromo-2-methylphenyl)morpholine (CID 130632472) is (3R)-3-(5-bromo-2-methylphenyl)morpholine.
What is the SMILES notation for (3R)-3-(5-bromo-2-methylphenyl)morpholine?
The canonical SMILES for (3R)-3-(5-bromo-2-methylphenyl)morpholine is Cc1ccc(Br)cc1[C@@H]1COCCN1.
What is the InChIKey of (3R)-3-(5-bromo-2-methylphenyl)morpholine?
The InChIKey is HSYYNBCYFTWKLU-NSHDSACASA-N. The full InChI is InChI=1S/C11H14BrNO/c1-8-2-3-9(12)6-10(8)11-7-14-5-4-13-11/h2-3,6,11,13H,4-5,7H2,1H3/t11-/m0/s1.
What are the key properties of (3R)-3-(5-bromo-2-methylphenyl)morpholine?
(3R)-3-(5-bromo-2-methylphenyl)morpholine has a molecular weight of 256.14 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(5-bromo-2-methylphenyl)morpholine is sourced from PubChem (CID 130632472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).