[4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol

C11H13ClFNO2 — CID 117009219

IUPAC[4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol
SMILESOCC1COCCN1c1ccc(F)c(Cl)c1
InChIInChI=1S/C11H13ClFNO2/c12-10-5-8(1-2-11(10)13)14-3-4-16-7-9(14)6-15/h1-2,5,9,15H,3-4,6-7H2
InChIKeyBPEWEBBOOCTLIZ-UHFFFAOYSA-N
MW245.68 g/mol
LogP1.68
Rot. Bonds2

About [4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol

[4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol (PubChem CID 117009219) has the molecular formula C11H13ClFNO2 and a molecular weight of 245.68 g/mol. Its IUPAC name is [4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol.

Molecular Properties

Compound Name[4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol
PubChem CID117009219
Molecular FormulaC11H13ClFNO2
Molecular Weight245.68 g/mol
Exact Mass245.06
IUPAC Name[4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol
SMILESOCC1COCCN1c1ccc(F)c(Cl)c1
InChIInChI=1S/C11H13ClFNO2/c12-10-5-8(1-2-11(10)13)14-3-4-16-7-9(14)6-15/h1-2,5,9,15H,3-4,6-7H2
InChIKeyBPEWEBBOOCTLIZ-UHFFFAOYSA-N
XLogP1.68
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.68
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol 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

[4-(3,4-diaminophenyl)morpholin-3-yl]methanol
CID 106751224
(4-phenylmorpholin-3-yl)methanol
CID 91802000
[4-(2-chlorophenyl)morpholin-3-yl]methanol
CID 117009212
[4-(5-chloro-2-methoxyphenyl)morpholin-3-yl]methanol
CID 117009222
[4-(4-methoxyphenyl)morpholin-3-yl]methanol
CID 117009227
[4-[(3-chloro-4-fluorophenyl)methyl]morpholin-3-yl]methanamine
CID 103038281
[1-(3-chloro-4-fluorophenyl)-2,2-dimethylpyrrolidin-3-yl]methanol
CID 117017752
[(3R)-4-(2,6-dichloro-5-fluoropyrimidin-4-yl)morpholin-3-yl]methanol
CID 87758454
(2-chloro-4-fluorophenyl)-[(3R)-3-(hydroxymethyl)morpholin-4-yl]methanone
CID 97040195
(1S)-1-[2-fluoro-6-[3-(hydroxymethyl)morpholin-4-yl]phenyl]ethanol
CID 104877438
[(3R)-4-[4-(1,3,5-triazin-2-ylamino)phenyl]morpholin-3-yl]methanol
CID 174854096
2-[1-(3-chloro-4-fluorophenyl)piperidin-2-yl]acetonitrile
CID 117028211

Frequently Asked Questions

What is the IUPAC name of [4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol?
The IUPAC name of [4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol (CID 117009219) is [4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol.
What is the SMILES notation for [4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol?
The canonical SMILES for [4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol is OCC1COCCN1c1ccc(F)c(Cl)c1.
What is the InChIKey of [4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol?
The InChIKey is BPEWEBBOOCTLIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClFNO2/c12-10-5-8(1-2-11(10)13)14-3-4-16-7-9(14)6-15/h1-2,5,9,15H,3-4,6-7H2.
What are the key properties of [4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol?
[4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol has a molecular weight of 245.68 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-chloro-4-fluorophenyl)morpholin-3-yl]methanol is sourced from PubChem (CID 117009219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).