N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine

C12H26N2O2 — CID 169214682

IUPACN-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine
SMILESCCCN1CCO[C@@H](COCCCNC)C1
InChIInChI=1S/C12H26N2O2/c1-3-6-14-7-9-16-12(10-14)11-15-8-4-5-13-2/h12-13H,3-11H2,1-2H3/t12-/m1/s1
InChIKeyFRQCRPHQZZJJSS-GFCCVEGCSA-N
MW230.35 g/mol
LogP0.72
Rot. Bonds8

About N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine

N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine (PubChem CID 169214682) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine.

Molecular Properties

Compound NameN-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine
PubChem CID169214682
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine
SMILESCCCN1CCO[C@@H](COCCCNC)C1
InChIInChI=1S/C12H26N2O2/c1-3-6-14-7-9-16-12(10-14)11-15-8-4-5-13-2/h12-13H,3-11H2,1-2H3/t12-/m1/s1
InChIKeyFRQCRPHQZZJJSS-GFCCVEGCSA-N
XLogP0.72
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-butyl-2-(propoxymethyl)morpholine;ethane
CID 169214166
2-[2-(dodecoxymethyl)morpholin-4-yl]ethanol;hydrochloride
CID 173446629
(2S)-4-(2-methylpropyl)-2-(pentoxymethyl)morpholine
CID 167191290
3-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methoxy]-N-propan-2-ylpropan-1-amine;molecular hydrogen
CID 161456094
3-[2-[(dimethylamino)methyl]morpholin-4-yl]-N-methylpropan-1-amine
CID 157048783
N-benzyl-3-[(4-ethylmorpholin-2-yl)methoxy]propan-1-amine
CID 114783008
N-[[4-[2-(4-methylpentoxy)ethyl]morpholin-2-yl]methyl]butan-1-amine
CID 171540678
N-[[4-(2-butoxyethyl)morpholin-2-yl]methyl]-2-methylpropan-1-amine
CID 163400398
(2R)-2-[(4-bromophenoxy)methyl]-4-propylmorpholine
CID 99979881
2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine
CID 94133449
N-methyl-3-(2-morpholin-4-ylethoxy)propan-1-amine
CID 163400432
N-(2-butoxyethyl)-2-(2-methylmorpholin-4-yl)ethanamine
CID 62575904

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine?
The IUPAC name of N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine (CID 169214682) is N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine.
What is the SMILES notation for N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine?
The canonical SMILES for N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine is CCCN1CCO[C@@H](COCCCNC)C1.
What is the InChIKey of N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine?
The InChIKey is FRQCRPHQZZJJSS-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-3-6-14-7-9-16-12(10-14)11-15-8-4-5-13-2/h12-13H,3-11H2,1-2H3/t12-/m1/s1.
What are the key properties of N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine?
N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine has a molecular weight of 230.35 g/mol, XLogP of 0.72, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[[(2R)-4-propylmorpholin-2-yl]methoxy]propan-1-amine is sourced from PubChem (CID 169214682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).