[4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol

C13H18ClNO2 — CID 102935440

IUPAC[4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(Cc2cccc(Cl)c2)CC(CO)O1
InChIInChI=1S/C13H18ClNO2/c1-10-6-15(8-13(9-16)17-10)7-11-3-2-4-12(14)5-11/h2-5,10,13,16H,6-9H2,1H3
InChIKeySOFLNLAJHXRYLF-UHFFFAOYSA-N
MW255.75 g/mol
LogP1.92
Rot. Bonds3

About [4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol

[4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol (PubChem CID 102935440) has the molecular formula C13H18ClNO2 and a molecular weight of 255.75 g/mol. Its IUPAC name is [4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol
PubChem CID102935440
Molecular FormulaC13H18ClNO2
Molecular Weight255.75 g/mol
Exact Mass255.10
IUPAC Name[4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(Cc2cccc(Cl)c2)CC(CO)O1
InChIInChI=1S/C13H18ClNO2/c1-10-6-15(8-13(9-16)17-10)7-11-3-2-4-12(14)5-11/h2-5,10,13,16H,6-9H2,1H3
InChIKeySOFLNLAJHXRYLF-UHFFFAOYSA-N
XLogP1.92
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.75
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-(hydroxymethyl)-6-methylmorpholin-4-yl]methyl]benzamide
CID 102935603
[4-[(2-amino-4-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol
CID 102932091
[4-[2-(3-chlorophenoxy)ethyl]-6-methylmorpholin-2-yl]methanol
CID 102935770
2-[4-[[2-(hydroxymethyl)-6-methylmorpholin-4-yl]methyl]phenyl]acetic acid
CID 102933414
4-benzyl-2-ethyl-6-methylmorpholine
CID 67357185
2-fluoro-5-[[2-(hydroxymethyl)-6-methylmorpholin-4-yl]methyl]benzonitrile
CID 102978174
[4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol
CID 102935735
[4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol
CID 102932163
3-tert-butyl-1-[(3-chlorophenyl)methyl]azetidine
CID 164927220
(2S,6R)-4-[(3-bromophenyl)methyl]-2,6-dimethylmorpholine
CID 779466
2-(chloromethyl)-4-[(2,4-dichlorophenyl)methyl]-6-methylmorpholine
CID 102936602
[4-[(3-methoxyphenyl)methyl]-6-methylmorpholin-2-yl]methanamine
CID 102938955

Frequently Asked Questions

What is the IUPAC name of [4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol (CID 102935440) is [4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol is CC1CN(Cc2cccc(Cl)c2)CC(CO)O1.
What is the InChIKey of [4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol?
The InChIKey is SOFLNLAJHXRYLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClNO2/c1-10-6-15(8-13(9-16)17-10)7-11-3-2-4-12(14)5-11/h2-5,10,13,16H,6-9H2,1H3.
What are the key properties of [4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol?
[4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol has a molecular weight of 255.75 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 102935440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).