[5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol

C13H21NO2 — CID 115691360

IUPAC[5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol
SMILESCCC1CCCC1NCc1ccc(CO)o1
InChIInChI=1S/C13H21NO2/c1-2-10-4-3-5-13(10)14-8-11-6-7-12(9-15)16-11/h6-7,10,13-15H,2-5,8-9H2,1H3
InChIKeyHRWWXFANTNUWOZ-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.44
Rot. Bonds5

About [5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol

[5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol (PubChem CID 115691360) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is [5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol.

Molecular Properties

Compound Name[5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol
PubChem CID115691360
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name[5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol
SMILESCCC1CCCC1NCc1ccc(CO)o1
InChIInChI=1S/C13H21NO2/c1-2-10-4-3-5-13(10)14-8-11-6-7-12(9-15)16-11/h6-7,10,13-15H,2-5,8-9H2,1H3
InChIKeyHRWWXFANTNUWOZ-UHFFFAOYSA-N
XLogP2.44
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(1-Pyrrolidinylmethyl)-2-furanmethanol
CID 16494992
5-[(Methylamino)methyl]-2-furanmethanol
CID 14671747
Ammonium, (5-hydroxymethylfurfuryl)trimethyl-, iodide
CID 47947
5-((Dimethylamino)methyl)-2-furanmethanol
CID 84906
((2-(Hydroxymethyl)-5-furyl)methyl)ammonium chloride
CID 3086123
[(2S,4R,5R)-5-(2-fluorophenyl)-4-[[[5-(hydroxymethyl)furan-2-yl]methylamino]methyl]-1-methylpyrrolidin-2-yl]methanol
CID 45186735
Methyl 5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-3-methylfuran-2-carboxylate
CID 53545163
(1S,2R,3R,5R)-3-(methoxymethyl)-5-[(5-methylfuran-2-yl)methylamino]cyclopentane-1,2-diol
CID 75529570
[5-[[Benzyl(methyl)amino]methyl]furan-2-yl]methanol
CID 10105294
(5-(piperidin-1-ylMethyl)furan-2-yl)Methanol
CID 10262066
(5-((Diethylamino)methyl)furan-2-yl)methanol
CID 11819706
5-(4-Morpholinylmethyl)-2-furanmethanol
CID 16494999

Frequently Asked Questions

What is the IUPAC name of [5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol?
The IUPAC name of [5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol (CID 115691360) is [5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol.
What is the SMILES notation for [5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol?
The canonical SMILES for [5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol is CCC1CCCC1NCc1ccc(CO)o1.
What is the InChIKey of [5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol?
The InChIKey is HRWWXFANTNUWOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-2-10-4-3-5-13(10)14-8-11-6-7-12(9-15)16-11/h6-7,10,13-15H,2-5,8-9H2,1H3.
What are the key properties of [5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol?
[5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol has a molecular weight of 223.32 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[[(2-ethylcyclopentyl)amino]methyl]furan-2-yl]methanol is sourced from PubChem (CID 115691360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).