2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol

C12H25NO3 — CID 103179565

IUPAC2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol
SMILESCOCCCOCCNCC1(CCO)CC1
InChIInChI=1S/C12H25NO3/c1-15-8-2-9-16-10-6-13-11-12(3-4-12)5-7-14/h13-14H,2-11H2,1H3
InChIKeyYWJWOXFJAZNJKN-UHFFFAOYSA-N
MW231.34 g/mol
LogP0.79
Rot. Bonds11

About 2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol

2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol (PubChem CID 103179565) has the molecular formula C12H25NO3 and a molecular weight of 231.34 g/mol. Its IUPAC name is 2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol.

Molecular Properties

Compound Name2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol
PubChem CID103179565
Molecular FormulaC12H25NO3
Molecular Weight231.34 g/mol
Exact Mass231.18
IUPAC Name2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol
SMILESCOCCCOCCNCC1(CCO)CC1
InChIInChI=1S/C12H25NO3/c1-15-8-2-9-16-10-6-13-11-12(3-4-12)5-7-14/h13-14H,2-11H2,1H3
InChIKeyYWJWOXFJAZNJKN-UHFFFAOYSA-N
XLogP0.79
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
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

2-[1-[[2-[2-(2-methoxyethoxy)ethoxy]ethylamino]methyl]cyclopropyl]ethanol
CID 114756460
N-[[1-(3-methoxypropyl)cyclopropyl]methyl]propan-1-amine
CID 66025997
[1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol
CID 115454729
2-[1-(propylaminomethyl)cyclopropyl]ethanol
CID 114756075
4-ethyl-1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclohexan-1-ol
CID 103179102
[1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol
CID 115359446
2-methoxy-N-[[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclobutyl]methyl]ethanamine
CID 104566649
N-[(1-hexylcyclopropyl)methyl]-2-methoxyethanamine
CID 66026488
2-[2-(4-methoxybutoxy)ethylamino]ethanol
CID 150215705
2-methoxy-N-[[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclopentyl]methyl]ethanamine
CID 104566535
2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol
CID 114756082
N-[[1-(chloromethyl)cyclopropyl]methyl]-2-propoxyethanamine
CID 106457795

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol?
The IUPAC name of 2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol (CID 103179565) is 2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol.
What is the SMILES notation for 2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol?
The canonical SMILES for 2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol is COCCCOCCNCC1(CCO)CC1.
What is the InChIKey of 2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol?
The InChIKey is YWJWOXFJAZNJKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO3/c1-15-8-2-9-16-10-6-13-11-12(3-4-12)5-7-14/h13-14H,2-11H2,1H3.
What are the key properties of 2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol?
2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol has a molecular weight of 231.34 g/mol, XLogP of 0.79, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol is sourced from PubChem (CID 103179565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).