[3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol

C11H21NO2 — CID 115249002

IUPAC[3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol
SMILESOCC1(CNCC2CCCC2)COC1
InChIInChI=1S/C11H21NO2/c13-7-11(8-14-9-11)6-12-5-10-3-1-2-4-10/h10,12-13H,1-9H2
InChIKeyZJALDTJEAMLGDQ-UHFFFAOYSA-N
MW199.29 g/mol
LogP0.78
Rot. Bonds5

About [3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol

[3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol (PubChem CID 115249002) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is [3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol.

Molecular Properties

Compound Name[3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol
PubChem CID115249002
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name[3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol
SMILESOCC1(CNCC2CCCC2)COC1
InChIInChI=1S/C11H21NO2/c13-7-11(8-14-9-11)6-12-5-10-3-1-2-4-10/h10,12-13H,1-9H2
InChIKeyZJALDTJEAMLGDQ-UHFFFAOYSA-N
XLogP0.78
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[(cyclobutylmethylamino)methyl]oxetan-3-yl]methanol
CID 115249008
3-[(cyclobutylmethylamino)methyl]oxetane-3-carboxylic acid
CID 115248458
[3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol
CID 167809144
N-[[1-(chloromethyl)cyclopropyl]methyl]-1-cyclohexylmethanamine
CID 115455707
N-[[1-(2-chloroethyl)cyclopropyl]methyl]-1-cyclopentylmethanamine
CID 114757546
N-[[3-(aminomethyl)oxetan-3-yl]methyl]-2-cyclopentylethanamine
CID 115249593
N-[[1-(chloromethyl)cyclopentyl]methyl]-1-cyclohexylmethanamine
CID 115363404
[3-(cyclohexylmethyl)oxolan-3-yl]methanol
CID 66060066
(2S)-2-cyclohexyl-2-[[3-(hydroxymethyl)oxetan-3-yl]methylamino]propan-1-ol
CID 99815019
[3-[[[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]amino]methyl]oxetan-3-yl]methanol
CID 115249172
[3-(cyclobutylmethyl)oxolan-3-yl]methanol
CID 130135661
1-[(cyclopentylmethylamino)methyl]cyclobutane-1-carboxylic acid
CID 115246539

Frequently Asked Questions

What is the IUPAC name of [3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol?
The IUPAC name of [3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol (CID 115249002) is [3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol.
What is the SMILES notation for [3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol?
The canonical SMILES for [3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol is OCC1(CNCC2CCCC2)COC1.
What is the InChIKey of [3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol?
The InChIKey is ZJALDTJEAMLGDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c13-7-11(8-14-9-11)6-12-5-10-3-1-2-4-10/h10,12-13H,1-9H2.
What are the key properties of [3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol?
[3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol has a molecular weight of 199.29 g/mol, XLogP of 0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(cyclopentylmethylamino)methyl]oxetan-3-yl]methanol is sourced from PubChem (CID 115249002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).