[4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol

C11H15ClN2O2 — CID 102824323

IUPAC[4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol
SMILESCC1COC(CO)CN1c1ccnc(Cl)c1
InChIInChI=1S/C11H15ClN2O2/c1-8-7-16-10(6-15)5-14(8)9-2-3-13-11(12)4-9/h2-4,8,10,15H,5-7H2,1H3
InChIKeyCOUJYQWQTNAPRZ-UHFFFAOYSA-N
MW242.71 g/mol
LogP1.32
Rot. Bonds2

About [4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol

[4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol (PubChem CID 102824323) has the molecular formula C11H15ClN2O2 and a molecular weight of 242.71 g/mol. Its IUPAC name is [4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol
PubChem CID102824323
Molecular FormulaC11H15ClN2O2
Molecular Weight242.71 g/mol
Exact Mass242.08
IUPAC Name[4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol
SMILESCC1COC(CO)CN1c1ccnc(Cl)c1
InChIInChI=1S/C11H15ClN2O2/c1-8-7-16-10(6-15)5-14(8)9-2-3-13-11(12)4-9/h2-4,8,10,15H,5-7H2,1H3
InChIKeyCOUJYQWQTNAPRZ-UHFFFAOYSA-N
XLogP1.32
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-4-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]benzonitrile
CID 81203842
[4-[(2-chloro-4-pyridinyl)methyl]-5-methylmorpholin-2-yl]methanol
CID 81203357
2-chloro-4-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]benzenecarbothioamide
CID 81204035
2-chloro-N'-hydroxy-4-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]benzenecarboximidamide
CID 81203511
[4-[4-(aminomethyl)-3-chloro-2-pyridinyl]-5-methylmorpholin-2-yl]methanol
CID 107055699
[4-(4-aminophenyl)-5-methylmorpholin-2-yl]methanol
CID 81206068
[5-methyl-4-[2-(methylamino)pyrimidin-4-yl]morpholin-2-yl]methanol
CID 81218201
2-amino-4-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]benzoic acid
CID 104500812
[5-methyl-4-(4-nitro-2-pyridinyl)morpholin-2-yl]methanol
CID 81219361
4-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]benzenecarbothioamide
CID 81202788
[4-(2-amino-5-chlorophenyl)-5-methylmorpholin-2-yl]methanol
CID 113315842
2-amino-4-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]benzenesulfonamide
CID 81205568

Frequently Asked Questions

What is the IUPAC name of [4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol (CID 102824323) is [4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol is CC1COC(CO)CN1c1ccnc(Cl)c1.
What is the InChIKey of [4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol?
The InChIKey is COUJYQWQTNAPRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O2/c1-8-7-16-10(6-15)5-14(8)9-2-3-13-11(12)4-9/h2-4,8,10,15H,5-7H2,1H3.
What are the key properties of [4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol?
[4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol has a molecular weight of 242.71 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-chloro-4-pyridinyl)-5-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 102824323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).