N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine

C12H25NO2 — CID 103178720

IUPACN-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine
SMILESCOCCCOCCNC1(C)CCCC1
InChIInChI=1S/C12H25NO2/c1-12(6-3-4-7-12)13-8-11-15-10-5-9-14-2/h13H,3-11H2,1-2H3
InChIKeyZIDRBWWPOCESQZ-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.96
Rot. Bonds8

About N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine

N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine (PubChem CID 103178720) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine
PubChem CID103178720
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC NameN-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine
SMILESCOCCCOCCNC1(C)CCCC1
InChIInChI=1S/C12H25NO2/c1-12(6-3-4-7-12)13-8-11-15-10-5-9-14-2/h13H,3-11H2,1-2H3
InChIKeyZIDRBWWPOCESQZ-UHFFFAOYSA-N
XLogP1.96
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(2-methoxyethoxy)propyl]-1-methylcyclobutan-1-amine
CID 103409682
N-(2-methoxyethyl)-N'-(1-methylcyclopentyl)ethane-1,2-diamine
CID 79290465
1-methyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-amine
CID 112588878
1-methoxy-3-[3-(3-methoxypropoxy)propoxy]propane
CID 6432627
5-methoxy-1-N-(1-methylcyclopentyl)pentane-1,2-diamine
CID 81102527
1-(chloromethyl)-N-[2-(3-methoxypropoxy)ethyl]-3-methylcyclohexan-1-amine
CID 103183987
4-(chloromethyl)-N-[2-(3-methoxypropoxy)ethyl]oxan-4-amine
CID 106299632
2-(3-methoxypropoxy)-N-[(3-methyloxetan-3-yl)methyl]ethanamine
CID 103179188
1-methyl-N-pentylcyclopentan-1-amine
CID 61365384
1-[2-(3-methoxypropoxy)ethyl]cyclobutan-1-amine
CID 103184766
N-[2-(3-methoxypropoxy)ethyl]but-2-yn-1-amine
CID 103179449
3-[2-(3-methoxypropoxy)ethylamino]-2,2-dimethylcyclobutan-1-ol
CID 103179563

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine?
The IUPAC name of N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine (CID 103178720) is N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine.
What is the SMILES notation for N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine?
The canonical SMILES for N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine is COCCCOCCNC1(C)CCCC1.
What is the InChIKey of N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine?
The InChIKey is ZIDRBWWPOCESQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-12(6-3-4-7-12)13-8-11-15-10-5-9-14-2/h13H,3-11H2,1-2H3.
What are the key properties of N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine?
N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine has a molecular weight of 215.34 g/mol, XLogP of 1.96, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxypropoxy)ethyl]-1-methylcyclopentan-1-amine is sourced from PubChem (CID 103178720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).