N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine

C15H33N3O — CID 167191852

IUPACN-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine
SMILESCCNCC[C@@H]1CN(CCN(C)CC(C)C)CCO1
InChIInChI=1S/C15H33N3O/c1-5-16-7-6-15-13-18(10-11-19-15)9-8-17(4)12-14(2)3/h14-16H,5-13H2,1-4H3/t15-/m1/s1
InChIKeyOBUPVCLKALZBLV-OAHLLOKOSA-N
MW271.45 g/mol
LogP1.27
Rot. Bonds9

About N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine

N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine (PubChem CID 167191852) has the molecular formula C15H33N3O and a molecular weight of 271.45 g/mol. Its IUPAC name is N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine
PubChem CID167191852
Molecular FormulaC15H33N3O
Molecular Weight271.45 g/mol
Exact Mass271.26
IUPAC NameN-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine
SMILESCCNCC[C@@H]1CN(CCN(C)CC(C)C)CCO1
InChIInChI=1S/C15H33N3O/c1-5-16-7-6-15-13-18(10-11-19-15)9-8-17(4)12-14(2)3/h14-16H,5-13H2,1-4H3/t15-/m1/s1
InChIKeyOBUPVCLKALZBLV-OAHLLOKOSA-N
XLogP1.27
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 51.27
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

N-[2-[(2R)-2-(2-aminoethyl)morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine
CID 164568142
N-[2-[2-(2-aminoethyl)morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine
CID 155750922
ethane;N-[[(2S)-4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N,2-dimethylpropan-1-amine;molecular hydrogen
CID 171539494
N,2-dimethyl-N-[[(2S)-4-[2-(propylamino)ethyl]morpholin-2-yl]methyl]propan-1-amine
CID 166800661
N,2-dimethyl-N-[3-[(2S)-2-[(propan-2-ylamino)methyl]morpholin-4-yl]propyl]propan-1-amine
CID 161322486
N-[[(2S)-4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-2-methylpropan-1-amine
CID 155188422
1-[methyl-[2-[(2R)-4-(4-methylpentyl)morpholin-2-yl]ethyl]amino]propane-2-thiol
CID 170115847
N-[2-(4-butylmorpholin-2-yl)ethyl]-N,2-dimethylbutan-1-amine
CID 170952081
(2R)-2,4-bis(4-methylpentyl)morpholine
CID 149421762
N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine
CID 138727106
N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-1-amine;N-methylpropan-1-amine
CID 155707617
N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]propan-1-amine
CID 155707218

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine?
The IUPAC name of N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine (CID 167191852) is N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine.
What is the SMILES notation for N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine?
The canonical SMILES for N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine is CCNCC[C@@H]1CN(CCN(C)CC(C)C)CCO1.
What is the InChIKey of N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine?
The InChIKey is OBUPVCLKALZBLV-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H33N3O/c1-5-16-7-6-15-13-18(10-11-19-15)9-8-17(4)12-14(2)3/h14-16H,5-13H2,1-4H3/t15-/m1/s1.
What are the key properties of N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine?
N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine has a molecular weight of 271.45 g/mol, XLogP of 1.27, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine is sourced from PubChem (CID 167191852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).