N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine

C14H30N2O — CID 83160848

IUPACN-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine
SMILESCCNC(CCCC(C)C)C1CN(C)CCO1
InChIInChI=1S/C14H30N2O/c1-5-15-13(8-6-7-12(2)3)14-11-16(4)9-10-17-14/h12-15H,5-11H2,1-4H3
InChIKeyVDWDTJARVLMUEP-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.12
Rot. Bonds7

About N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine

N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine (PubChem CID 83160848) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine.

Molecular Properties

Compound NameN-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine
PubChem CID83160848
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC NameN-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine
SMILESCCNC(CCCC(C)C)C1CN(C)CCO1
InChIInChI=1S/C14H30N2O/c1-5-15-13(8-6-7-12(2)3)14-11-16(4)9-10-17-14/h12-15H,5-11H2,1-4H3
InChIKeyVDWDTJARVLMUEP-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine?
The IUPAC name of N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine (CID 83160848) is N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine.
What is the SMILES notation for N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine?
The canonical SMILES for N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine is CCNC(CCCC(C)C)C1CN(C)CCO1.
What is the InChIKey of N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine?
The InChIKey is VDWDTJARVLMUEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-5-15-13(8-6-7-12(2)3)14-11-16(4)9-10-17-14/h12-15H,5-11H2,1-4H3.
What are the key properties of N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine?
N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 2.12, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methyl-1-(4-methylmorpholin-2-yl)hexan-1-amine is sourced from PubChem (CID 83160848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).