N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine

C15H32N2O — CID 55072215

IUPACN,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine
SMILESCCC(CC)CN(CC)CC1CCC(CNC)O1
InChIInChI=1S/C15H32N2O/c1-5-13(6-2)11-17(7-3)12-15-9-8-14(18-15)10-16-4/h13-16H,5-12H2,1-4H3
InChIKeyFMIUCQKLTPZKGE-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.51
Rot. Bonds9

About N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine

N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine (PubChem CID 55072215) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine.

Molecular Properties

Compound NameN,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine
PubChem CID55072215
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC NameN,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine
SMILESCCC(CC)CN(CC)CC1CCC(CNC)O1
InChIInChI=1S/C15H32N2O/c1-5-13(6-2)11-17(7-3)12-15-9-8-14(18-15)10-16-4/h13-16H,5-12H2,1-4H3
InChIKeyFMIUCQKLTPZKGE-UHFFFAOYSA-N
XLogP2.51
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-methyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]prop-2-en-1-amine
CID 62418405
N-ethyl-N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-2-methylbutan-1-amine
CID 79482402
N-[[5-[[ethyl(2-methylpropyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 55074640
1-[5-[(dimethylamino)methyl]oxolan-2-yl]-N-methylmethanamine
CID 62419753
N,N,N'-triethyl-N'-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]propane-1,3-diamine
CID 102997663
N-(cyclohexylmethyl)-N'-ethyl-N'-(2-ethylbutyl)ethane-1,2-diamine
CID 63503578
N-ethyl-2-methyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]aniline
CID 62425314
N-ethyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]butan-2-amine
CID 62422388
N-[[5-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine
CID 62426631
2-[[ethyl(2-ethylbutyl)amino]methyl]-N,4-dimethylcyclohexan-1-amine
CID 63495552
N-ethyl-3-fluoro-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]aniline
CID 55074213
N-[[5-[[benzyl(ethyl)amino]methyl]oxolan-2-yl]methyl]propan-1-amine
CID 62419666

Frequently Asked Questions

What is the IUPAC name of N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine?
The IUPAC name of N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine (CID 55072215) is N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine.
What is the SMILES notation for N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine?
The canonical SMILES for N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine is CCC(CC)CN(CC)CC1CCC(CNC)O1.
What is the InChIKey of N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine?
The InChIKey is FMIUCQKLTPZKGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-5-13(6-2)11-17(7-3)12-15-9-8-14(18-15)10-16-4/h13-16H,5-12H2,1-4H3.
What are the key properties of N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine?
N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine has a molecular weight of 256.43 g/mol, XLogP of 2.51, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-diethyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]butan-1-amine is sourced from PubChem (CID 55072215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).