N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine

C14H30N2O2 — CID 62390798

IUPACN-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine
SMILESCCN(CC1(CNC)CCOCC1)C(C)COC
InChIInChI=1S/C14H30N2O2/c1-5-16(13(2)10-17-4)12-14(11-15-3)6-8-18-9-7-14/h13,15H,5-12H2,1-4H3
InChIKeyFNFZEOMHIVOXCC-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.36
Rot. Bonds8

About N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine

N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine (PubChem CID 62390798) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine
PubChem CID62390798
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC NameN-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine
SMILESCCN(CC1(CNC)CCOCC1)C(C)COC
InChIInChI=1S/C14H30N2O2/c1-5-16(13(2)10-17-4)12-14(11-15-3)6-8-18-9-7-14/h13,15H,5-12H2,1-4H3
InChIKeyFNFZEOMHIVOXCC-UHFFFAOYSA-N
XLogP1.36
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine?
The IUPAC name of N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine (CID 62390798) is N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine.
What is the SMILES notation for N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine?
The canonical SMILES for N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine is CCN(CC1(CNC)CCOCC1)C(C)COC.
What is the InChIKey of N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine?
The InChIKey is FNFZEOMHIVOXCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-5-16(13(2)10-17-4)12-14(11-15-3)6-8-18-9-7-14/h13,15H,5-12H2,1-4H3.
What are the key properties of N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine?
N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine has a molecular weight of 258.41 g/mol, XLogP of 1.36, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-methoxy-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 62390798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).