2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine

C9H20N2O — CID 94133449

IUPAC2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine
SMILESCCN1CCO[C@@H](CCNC)C1
InChIInChI=1S/C9H20N2O/c1-3-11-6-7-12-9(8-11)4-5-10-2/h9-10H,3-8H2,1-2H3/t9-/m0/s1
InChIKeyCNPAEAMYBMQROY-VIFPVBQESA-N
MW172.27 g/mol
LogP0.32
Rot. Bonds4

About 2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine

2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine (PubChem CID 94133449) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine.

Molecular Properties

Compound Name2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine
PubChem CID94133449
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine
SMILESCCN1CCO[C@@H](CCNC)C1
InChIInChI=1S/C9H20N2O/c1-3-11-6-7-12-9(8-11)4-5-10-2/h9-10H,3-8H2,1-2H3/t9-/m0/s1
InChIKeyCNPAEAMYBMQROY-VIFPVBQESA-N
XLogP0.32
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2R)-4-ethylmorpholin-2-yl]-N-methylethanamine;molecular hydrogen
CID 169214323
N-[2-(4-ethylmorpholin-2-yl)ethyl]-2-methylpropan-2-amine
CID 162424315
4-ethyl-2-propylmorpholine
CID 127673597
2,4-diethylmorpholine
CID 58988021
N-methyl-1-(2-propylmorpholin-4-yl)methanamine
CID 167045533
2-(4-ethyl-1,4-oxazepan-7-yl)-N-iodoethanamine
CID 155354329
3-[(2S)-4-ethylmorpholin-2-yl]propanoic acid
CID 95426355
2-[(4-ethylmorpholin-2-yl)methyl]-1,1-dimethylhydrazine
CID 83013622
2-cyclohexyl-N-[(4-ethylmorpholin-2-yl)methyl]ethanamine
CID 79163993
2-(4-ethylmorpholin-2-yl)acetonitrile
CID 79164435
N-[(4-ethylmorpholin-2-yl)methyl]-3,3,3-trifluoropropan-1-amine
CID 79165763
3-bromo-N-[(4-ethylmorpholin-2-yl)methyl]propan-1-amine
CID 114293488

Frequently Asked Questions

What is the IUPAC name of 2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine?
The IUPAC name of 2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine (CID 94133449) is 2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine.
What is the SMILES notation for 2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine?
The canonical SMILES for 2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine is CCN1CCO[C@@H](CCNC)C1.
What is the InChIKey of 2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine?
The InChIKey is CNPAEAMYBMQROY-VIFPVBQESA-N. The full InChI is InChI=1S/C9H20N2O/c1-3-11-6-7-12-9(8-11)4-5-10-2/h9-10H,3-8H2,1-2H3/t9-/m0/s1.
What are the key properties of 2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine?
2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine has a molecular weight of 172.27 g/mol, XLogP of 0.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine is sourced from PubChem (CID 94133449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).