2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine

C14H31NO2 — CID 106456931

IUPAC2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine
SMILESCCC(C)(CCOCC(C)C)CNCCOC
InChIInChI=1S/C14H31NO2/c1-6-14(4,12-15-8-10-16-5)7-9-17-11-13(2)3/h13,15H,6-12H2,1-5H3
InChIKeyJCRKTEUIEMDUDC-UHFFFAOYSA-N
MW245.41 g/mol
LogP2.70
Rot. Bonds11

About 2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine

2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine (PubChem CID 106456931) has the molecular formula C14H31NO2 and a molecular weight of 245.41 g/mol. Its IUPAC name is 2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine.

Molecular Properties

Compound Name2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine
PubChem CID106456931
Molecular FormulaC14H31NO2
Molecular Weight245.41 g/mol
Exact Mass245.24
IUPAC Name2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine
SMILESCCC(C)(CCOCC(C)C)CNCCOC
InChIInChI=1S/C14H31NO2/c1-6-14(4,12-15-8-10-16-5)7-9-17-11-13(2)3/h13,15H,6-12H2,1-5H3
InChIKeyJCRKTEUIEMDUDC-UHFFFAOYSA-N
XLogP2.70
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 52.70
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

2-ethyl-N-(2-methoxyethyl)-2,4-dimethylpentan-1-amine
CID 62720062
N-(2-methoxyethyl)-2-methyl-2-[2-(2-methylpropoxy)ethyl]but-3-en-1-amine
CID 106457338
2-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-2-methyl-N-propylbutan-1-amine
CID 104566584
N-(2-methoxyethyl)-2,6-dimethyl-2-propylheptan-1-amine
CID 83168794
2,2-diethyl-4-[2-(2-methoxyethoxy)ethoxy]-N-(2-methoxyethyl)butan-1-amine
CID 104566572
1-chloro-2-(chloromethyl)-2-methyl-4-(2-methylpropoxy)butane
CID 106459785
4-ethoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine
CID 62725159
2-(chloromethyl)-2-ethyl-N-[2-(2-methylpropoxy)ethyl]butan-1-amine
CID 106252397
N-tert-butyl-2-methyl-2-[2-(2-methylpropoxy)ethyl]pentan-1-amine
CID 106456865
2-[[2-(2-methoxyethoxy)ethylamino]methyl]-2-methylbutan-1-ol
CID 81418619
2-ethyl-N-(2-methoxyethyl)-2-methyl-4-phenylsulfanylbutan-1-amine
CID 79227224
N-(2-methoxyethyl)-2,5,5-trimethyl-2-propylhexan-1-amine
CID 55196240

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine?
The IUPAC name of 2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine (CID 106456931) is 2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine.
What is the SMILES notation for 2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine?
The canonical SMILES for 2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine is CCC(C)(CCOCC(C)C)CNCCOC.
What is the InChIKey of 2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine?
The InChIKey is JCRKTEUIEMDUDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO2/c1-6-14(4,12-15-8-10-16-5)7-9-17-11-13(2)3/h13,15H,6-12H2,1-5H3.
What are the key properties of 2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine?
2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine has a molecular weight of 245.41 g/mol, XLogP of 2.70, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(2-methoxyethyl)-2-methyl-4-(2-methylpropoxy)butan-1-amine is sourced from PubChem (CID 106456931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).