1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine

C14H30N2O2 — CID 112752546

IUPAC1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine
SMILESCOCCOCCNCC1(N(C)C)CCCCC1
InChIInChI=1S/C14H30N2O2/c1-16(2)14(7-5-4-6-8-14)13-15-9-10-18-12-11-17-3/h15H,4-13H2,1-3H3
InChIKeyBXDHXCOFQSOOOM-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.50
Rot. Bonds9

About 1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine

1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine (PubChem CID 112752546) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine
PubChem CID112752546
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine
SMILESCOCCOCCNCC1(N(C)C)CCCCC1
InChIInChI=1S/C14H30N2O2/c1-16(2)14(7-5-4-6-8-14)13-15-9-10-18-12-11-17-3/h15H,4-13H2,1-3H3
InChIKeyBXDHXCOFQSOOOM-UHFFFAOYSA-N
XLogP1.50
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[[1-(dimethylamino)cyclohexyl]methyl]-2-(2-methoxyethylamino)acetamide
CID 78914071
N,N-dimethyl-1-[[2-[(2-methylpropan-2-yl)oxy]ethylamino]methyl]cyclobutan-1-amine
CID 105416787
[1-[[2-(2-methoxyethoxy)ethylamino]methyl]cyclopentyl]methanol
CID 115359446
2-[2-(2-methoxyethoxy)ethoxy]-N-[(1-methylsulfanylcyclobutyl)methyl]ethanamine
CID 114116392
2-methoxy-N-[[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclopentyl]methyl]ethanamine
CID 104566535
2-methoxy-N-[[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclobutyl]methyl]ethanamine
CID 104566649
methyl 4-[[1-(dimethylamino)cyclopentyl]methylamino]butanoate
CID 83121631
N,N-dimethyl-1-[(3-methylsulfanylpropylamino)methyl]cyclohexan-1-amine
CID 28622139
3-[[1-(dimethylamino)cyclobutyl]methylamino]propanoic acid
CID 105416372
2-[1-[[2-[2-(2-methoxyethoxy)ethoxy]ethylamino]methyl]cyclopropyl]ethanol
CID 114756460
methyl 4-[[1-(dimethylamino)cyclobutyl]methylamino]butanoate
CID 105416398
N-[[1-(dimethylamino)cyclobutyl]methyl]-N',N'-dimethylpropane-1,3-diamine
CID 105416972

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine?
The IUPAC name of 1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine (CID 112752546) is 1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine.
What is the SMILES notation for 1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine?
The canonical SMILES for 1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine is COCCOCCNCC1(N(C)C)CCCCC1.
What is the InChIKey of 1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine?
The InChIKey is BXDHXCOFQSOOOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-16(2)14(7-5-4-6-8-14)13-15-9-10-18-12-11-17-3/h15H,4-13H2,1-3H3.
What are the key properties of 1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine?
1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine has a molecular weight of 258.41 g/mol, XLogP of 1.50, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(2-methoxyethoxy)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine is sourced from PubChem (CID 112752546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).