[4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol

C12H23NO3 — CID 81212944

IUPAC[4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol
SMILESOCC1CN(CC2(CO)CCCC2)CCO1
InChIInChI=1S/C12H23NO3/c14-8-11-7-13(5-6-16-11)9-12(10-15)3-1-2-4-12/h11,14-15H,1-10H2
InChIKeyYCHNDHDWGWMRIL-UHFFFAOYSA-N
MW229.32 g/mol
LogP0.23
Rot. Bonds4

About [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol

[4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol (PubChem CID 81212944) has the molecular formula C12H23NO3 and a molecular weight of 229.32 g/mol. Its IUPAC name is [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol
PubChem CID81212944
Molecular FormulaC12H23NO3
Molecular Weight229.32 g/mol
Exact Mass229.17
IUPAC Name[4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol
SMILESOCC1CN(CC2(CO)CCCC2)CCO1
InChIInChI=1S/C12H23NO3/c14-8-11-7-13(5-6-16-11)9-12(10-15)3-1-2-4-12/h11,14-15H,1-10H2
InChIKeyYCHNDHDWGWMRIL-UHFFFAOYSA-N
XLogP0.23
TPSA52.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol?
The IUPAC name of [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol (CID 81212944) is [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol is OCC1CN(CC2(CO)CCCC2)CCO1.
What is the InChIKey of [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol?
The InChIKey is YCHNDHDWGWMRIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3/c14-8-11-7-13(5-6-16-11)9-12(10-15)3-1-2-4-12/h11,14-15H,1-10H2.
What are the key properties of [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol?
[4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol has a molecular weight of 229.32 g/mol, XLogP of 0.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol is sourced from PubChem (CID 81212944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).