[1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol

C12H25NO3 — CID 115359446

IUPAC[1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol
SMILESCOCCOCCNCC1(CO)CCCC1
InChIInChI=1S/C12H25NO3/c1-15-8-9-16-7-6-13-10-12(11-14)4-2-3-5-12/h13-14H,2-11H2,1H3
InChIKeyBQDZYTSTIFZQIW-UHFFFAOYSA-N
MW231.34 g/mol
LogP0.79
Rot. Bonds9

About [1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol

[1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol (PubChem CID 115359446) has the molecular formula C12H25NO3 and a molecular weight of 231.34 g/mol. Its IUPAC name is [1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol
PubChem CID115359446
Molecular FormulaC12H25NO3
Molecular Weight231.34 g/mol
Exact Mass231.18
IUPAC Name[1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol
SMILESCOCCOCCNCC1(CO)CCCC1
InChIInChI=1S/C12H25NO3/c1-15-8-9-16-7-6-13-10-12(11-14)4-2-3-5-12/h13-14H,2-11H2,1H3
InChIKeyBQDZYTSTIFZQIW-UHFFFAOYSA-N
XLogP0.79
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

[1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol
CID 115454729
2-methoxy-N-[[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclopentyl]methyl]ethanamine
CID 104566535
[1-[[2-(3-methylbutoxy)ethylamino]methyl]cyclopentyl]methanol
CID 115359624
2-[1-[[2-[2-(2-methoxyethoxy)ethoxy]ethylamino]methyl]cyclopropyl]ethanol
CID 114756460
2-methoxy-N-[[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclobutyl]methyl]ethanamine
CID 104566649
[1-[[2-[(2-methylpropan-2-yl)oxy]ethylamino]methyl]cyclohexyl]methanol
CID 113359626
2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-(2-methoxyethyl)acetamide
CID 113293821
1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine
CID 112752546
2-[1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopropyl]acetonitrile
CID 65496681
2-methoxy-N-[[1-(2-methoxyethyl)cyclohexyl]methyl]ethanamine
CID 62723578
methyl 2-[[1-(hydroxymethyl)cyclopentyl]methylamino]acetate
CID 115359540
2-[2-(2-methoxyethoxy)ethoxy]-N-[(1-methylsulfanylcyclobutyl)methyl]ethanamine
CID 114116392

Frequently Asked Questions

What is the IUPAC name of [1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol?
The IUPAC name of [1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol (CID 115359446) is [1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol?
The canonical SMILES for [1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol is COCCOCCNCC1(CO)CCCC1.
What is the InChIKey of [1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol?
The InChIKey is BQDZYTSTIFZQIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO3/c1-15-8-9-16-7-6-13-10-12(11-14)4-2-3-5-12/h13-14H,2-11H2,1H3.
What are the key properties of [1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol?
[1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol has a molecular weight of 231.34 g/mol, XLogP of 0.79, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 115359446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).