2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol

C14H20ClNO2 — CID 107559679

IUPAC2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol
SMILESCc1ccc(C(C)(O)CC2COCCN2)cc1Cl
InChIInChI=1S/C14H20ClNO2/c1-10-3-4-11(7-13(10)15)14(2,17)8-12-9-18-6-5-16-12/h3-4,7,12,16-17H,5-6,8-9H2,1-2H3
InChIKeyWUPVZNKIFTYSOB-UHFFFAOYSA-N
MW269.77 g/mol
LogP2.23
Rot. Bonds3

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

2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol (PubChem CID 107559679) has the molecular formula C14H20ClNO2 and a molecular weight of 269.77 g/mol. Its IUPAC name is 2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol.

Molecular Properties

Compound Name2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol
PubChem CID107559679
Molecular FormulaC14H20ClNO2
Molecular Weight269.77 g/mol
Exact Mass269.12
IUPAC Name2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol
SMILESCc1ccc(C(C)(O)CC2COCCN2)cc1Cl
InChIInChI=1S/C14H20ClNO2/c1-10-3-4-11(7-13(10)15)14(2,17)8-12-9-18-6-5-16-12/h3-4,7,12,16-17H,5-6,8-9H2,1-2H3
InChIKeyWUPVZNKIFTYSOB-UHFFFAOYSA-N
XLogP2.23
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.77
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-chloro-4-methylphenyl)-1-piperidin-2-ylpropan-2-ol
CID 107559678
2-[3-(2-methylpropyl)phenyl]-1-morpholin-3-ylpropan-2-ol
CID 116542872
2-(2,6-difluorophenyl)-1-morpholin-3-ylpropan-2-ol
CID 113462063
3-[(4-tert-butyl-2-methylphenyl)methyl]morpholine
CID 116927963
2-(5-methyl-1-benzofuran-2-yl)-1-morpholin-3-ylpropan-2-ol
CID 114724818
1-(4-chloro-2-fluorophenyl)-2-methyl-3-morpholin-3-ylpropan-2-ol
CID 114852724
1-bromo-1,1-difluoro-2-methyl-3-morpholin-3-ylpropan-2-ol
CID 107140363
3-[(4-chloro-2-methylphenyl)methyl]morpholine
CID 82287728
3-[(4-chloro-3-methylphenyl)sulfanylmethyl]morpholine
CID 117034360
3-[(5-chloro-2-methoxy-4-methylphenyl)methyl]morpholine
CID 116927929
3-[3-(2,3-dichlorophenyl)-2-fluoro-2-methylpropyl]morpholine
CID 107311248
3-[(3,4-dimethylphenyl)sulfanylmethyl]morpholine
CID 117034338

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol?
The IUPAC name of 2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol (CID 107559679) is 2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol.
What is the SMILES notation for 2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol?
The canonical SMILES for 2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol is Cc1ccc(C(C)(O)CC2COCCN2)cc1Cl.
What is the InChIKey of 2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol?
The InChIKey is WUPVZNKIFTYSOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO2/c1-10-3-4-11(7-13(10)15)14(2,17)8-12-9-18-6-5-16-12/h3-4,7,12,16-17H,5-6,8-9H2,1-2H3.
What are the key properties of 2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol?
2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol has a molecular weight of 269.77 g/mol, XLogP of 2.23, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-methylphenyl)-1-morpholin-3-ylpropan-2-ol is sourced from PubChem (CID 107559679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).