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

C12H17ClN2O2 — CID 102935735

IUPAC[4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(Cc2ccncc2Cl)CC(CO)O1
InChIInChI=1S/C12H17ClN2O2/c1-9-5-15(7-11(8-16)17-9)6-10-2-3-14-4-12(10)13/h2-4,9,11,16H,5-8H2,1H3
InChIKeyCLAFOOZRFSLWJJ-UHFFFAOYSA-N
MW256.73 g/mol
LogP1.32
Rot. Bonds3

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

[4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol (PubChem CID 102935735) has the molecular formula C12H17ClN2O2 and a molecular weight of 256.73 g/mol. Its IUPAC name is [4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol
PubChem CID102935735
Molecular FormulaC12H17ClN2O2
Molecular Weight256.73 g/mol
Exact Mass256.10
IUPAC Name[4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(Cc2ccncc2Cl)CC(CO)O1
InChIInChI=1S/C12H17ClN2O2/c1-9-5-15(7-11(8-16)17-9)6-10-2-3-14-4-12(10)13/h2-4,9,11,16H,5-8H2,1H3
InChIKeyCLAFOOZRFSLWJJ-UHFFFAOYSA-N
XLogP1.32
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.73
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-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

2-(chloromethyl)-6-methyl-4-(pyridin-4-ylmethyl)morpholine
CID 102936755
3-chloro-4-[[2-(hydroxymethyl)-6-methylmorpholin-4-yl]methyl]benzamide
CID 102935941
[4-[(2-amino-4-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol
CID 102932091
2-[4-[[2-(hydroxymethyl)-6-methylmorpholin-4-yl]methyl]phenyl]acetic acid
CID 102933414
[4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol
CID 102935440
2-(chloromethyl)-4-[(2,4-dichlorophenyl)methyl]-6-methylmorpholine
CID 102936602
[6-methyl-4-(1,3-thiazol-5-ylmethyl)morpholin-2-yl]methanol
CID 102935669
(3S)-1-[(3-chloro-4-pyridinyl)methyl]pyrrolidin-3-ol
CID 79031489
[6-methyl-4-[(1-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol
CID 102935937
3-chloro-4-[(4-chloro-3-methylpiperidin-1-yl)methyl]pyridine
CID 114682329
[(3S,4R)-4-[[(2S,6R)-2,6-dimethylmorpholin-4-yl]methyl]-1-(pyridin-4-ylmethyl)pyrrolidin-3-yl]methanol
CID 133124516
4-[(3-chloro-4-pyridinyl)methyl]-2-(2-methoxyethyl)morpholine
CID 77085876

Frequently Asked Questions

What is the IUPAC name of [4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol (CID 102935735) is [4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol is CC1CN(Cc2ccncc2Cl)CC(CO)O1.
What is the InChIKey of [4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol?
The InChIKey is CLAFOOZRFSLWJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O2/c1-9-5-15(7-11(8-16)17-9)6-10-2-3-14-4-12(10)13/h2-4,9,11,16H,5-8H2,1H3.
What are the key properties of [4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol?
[4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol has a molecular weight of 256.73 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(3-chloro-4-pyridinyl)methyl]-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 102935735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).