N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine

C12H24N2O2 — CID 116956880

IUPACN-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine
SMILESCNC(CC1CNCCO1)C1CCOCC1
InChIInChI=1S/C12H24N2O2/c1-13-12(10-2-5-15-6-3-10)8-11-9-14-4-7-16-11/h10-14H,2-9H2,1H3
InChIKeyRLSUAIPONKBENZ-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.38
Rot. Bonds4

About N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine

N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine (PubChem CID 116956880) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine
PubChem CID116956880
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine
SMILESCNC(CC1CNCCO1)C1CCOCC1
InChIInChI=1S/C12H24N2O2/c1-13-12(10-2-5-15-6-3-10)8-11-9-14-4-7-16-11/h10-14H,2-9H2,1H3
InChIKeyRLSUAIPONKBENZ-UHFFFAOYSA-N
XLogP0.38
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine?
The IUPAC name of N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine (CID 116956880) is N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine.
What is the SMILES notation for N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine?
The canonical SMILES for N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine is CNC(CC1CNCCO1)C1CCOCC1.
What is the InChIKey of N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine?
The InChIKey is RLSUAIPONKBENZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-13-12(10-2-5-15-6-3-10)8-11-9-14-4-7-16-11/h10-14H,2-9H2,1H3.
What are the key properties of N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine?
N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine has a molecular weight of 228.34 g/mol, XLogP of 0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-morpholin-2-yl-1-(oxan-4-yl)ethanamine is sourced from PubChem (CID 116956880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).