[4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol

C12H23NO4 — CID 81214239

IUPAC[4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol
SMILESOCC1CN(CC2(CO)CCOCC2)CCO1
InChIInChI=1S/C12H23NO4/c14-8-11-7-13(3-6-17-11)9-12(10-15)1-4-16-5-2-12/h11,14-15H,1-10H2
InChIKeyZCHJINRWPSAZIQ-UHFFFAOYSA-N
MW245.32 g/mol
LogP-0.53
Rot. Bonds4

About [4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol

[4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol (PubChem CID 81214239) has the molecular formula C12H23NO4 and a molecular weight of 245.32 g/mol. Its IUPAC name is [4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol
PubChem CID81214239
Molecular FormulaC12H23NO4
Molecular Weight245.32 g/mol
Exact Mass245.16
IUPAC Name[4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol
SMILESOCC1CN(CC2(CO)CCOCC2)CCO1
InChIInChI=1S/C12H23NO4/c14-8-11-7-13(3-6-17-11)9-12(10-15)1-4-16-5-2-12/h11,14-15H,1-10H2
InChIKeyZCHJINRWPSAZIQ-UHFFFAOYSA-N
XLogP-0.53
TPSA62.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 5-0.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol with MolForge

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Related Compounds

[4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol
CID 81212944
[4-[(2-ethylmorpholin-4-yl)methyl]oxan-4-yl]methanol
CID 55067295
[4-[(4-methyloxan-4-yl)methyl]morpholin-2-yl]methanol
CID 104585572
[4-[[3-[(2-methylpropylamino)methyl]oxolan-3-yl]methyl]morpholin-2-yl]methanol
CID 81214333
[4-[[1-(propylaminomethyl)cycloheptyl]methyl]morpholin-2-yl]methanol
CID 81213477
[4-[(3-methylpiperidin-1-yl)methyl]oxan-4-yl]methanol
CID 62391715
1-[[2-(hydroxymethyl)morpholin-4-yl]methyl]cyclohexane-1-carbaldehyde
CID 81212922
N-[[4-[(2-ethylmorpholin-4-yl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62391826
[4-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]oxan-4-yl]methanol
CID 64581388
[4-[(4-methylpiperidin-1-yl)methyl]oxan-4-yl]methanol
CID 62391366
(4-prop-2-ynylmorpholin-2-yl)methanol
CID 79833462
trifluoro-[[2-(hydroxymethyl)morpholin-4-yl]methyl]boranuide
CID 79016153

Frequently Asked Questions

What is the IUPAC name of [4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol?
The IUPAC name of [4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol (CID 81214239) is [4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol is OCC1CN(CC2(CO)CCOCC2)CCO1.
What is the InChIKey of [4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol?
The InChIKey is ZCHJINRWPSAZIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO4/c14-8-11-7-13(3-6-17-11)9-12(10-15)1-4-16-5-2-12/h11,14-15H,1-10H2.
What are the key properties of [4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol?
[4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol has a molecular weight of 245.32 g/mol, XLogP of -0.53, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[4-(hydroxymethyl)oxan-4-yl]methyl]morpholin-2-yl]methanol is sourced from PubChem (CID 81214239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).