1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol

C14H19ClFNO2 — CID 114852724

IUPAC1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol
SMILESCC(O)(Cc1ccc(Cl)cc1F)CC1COCCN1
InChIInChI=1S/C14H19ClFNO2/c1-14(18,8-12-9-19-5-4-17-12)7-10-2-3-11(15)6-13(10)16/h2-3,6,12,17-18H,4-5,7-9H2,1H3
InChIKeySNZVWUGFKDQPGN-UHFFFAOYSA-N
MW287.76 g/mol
LogP2.15
Rot. Bonds4

About 1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol

1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol (PubChem CID 114852724) has the molecular formula C14H19ClFNO2 and a molecular weight of 287.76 g/mol. Its IUPAC name is 1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol.

Molecular Properties

Compound Name1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol
PubChem CID114852724
Molecular FormulaC14H19ClFNO2
Molecular Weight287.76 g/mol
Exact Mass287.11
IUPAC Name1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol
SMILESCC(O)(Cc1ccc(Cl)cc1F)CC1COCCN1
InChIInChI=1S/C14H19ClFNO2/c1-14(18,8-12-9-19-5-4-17-12)7-10-2-3-11(15)6-13(10)16/h2-3,6,12,17-18H,4-5,7-9H2,1H3
InChIKeySNZVWUGFKDQPGN-UHFFFAOYSA-N
XLogP2.15
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.76
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,6-difluorophenyl)-1-morpholin-3-ylpropan-2-ol
CID 113462063
3-[(4-chloro-2-methylphenyl)methyl]morpholine
CID 82287728
N-[(5-chloro-2-fluorophenyl)methyl]-N-methyl-1-morpholin-3-ylmethanamine
CID 117044833
2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol
CID 107559679
3-[3-(2,3-dichlorophenyl)-2-fluoro-2-methylpropyl]morpholine
CID 107311248
1-bromo-1,1-difluoro-2-methyl-3-morpholin-3-ylpropan-2-ol
CID 107140363
3-[2-(3-bromo-2,6-difluorophenyl)-2-fluoropropyl]morpholine
CID 106943968
1-(4-chloro-2-fluorophenyl)-2,3,3-trimethylbutan-2-ol
CID 114852559
3-[(5-chloro-2-methoxyphenyl)methyl]morpholine
CID 82293165
1-(4-chloro-2-fluorophenyl)-2,5-dimethylhexan-2-ol
CID 114280035
1-(2,5-difluorophenyl)-3-morpholin-3-ylpropan-2-one
CID 116595683
1-(4-fluoro-2-methylphenyl)-2-methyl-3-piperidin-2-ylpropan-2-ol
CID 114347033

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol?
The IUPAC name of 1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol (CID 114852724) is 1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol.
What is the SMILES notation for 1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol?
The canonical SMILES for 1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol is CC(O)(Cc1ccc(Cl)cc1F)CC1COCCN1.
What is the InChIKey of 1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol?
The InChIKey is SNZVWUGFKDQPGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClFNO2/c1-14(18,8-12-9-19-5-4-17-12)7-10-2-3-11(15)6-13(10)16/h2-3,6,12,17-18H,4-5,7-9H2,1H3.
What are the key properties of 1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol?
1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol has a molecular weight of 287.76 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol is sourced from PubChem (CID 114852724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).