N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine

C14H30N2O — CID 138727106

IUPACN-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine
SMILESCCN(C)C[C@H]1CN(CCCC(C)C)CCO1
InChIInChI=1S/C14H30N2O/c1-5-15(4)11-14-12-16(9-10-17-14)8-6-7-13(2)3/h13-14H,5-12H2,1-4H3/t14-/m0/s1
InChIKeyBESZXCDBBQGUQG-AWEZNQCLSA-N
MW242.41 g/mol
LogP2.08
Rot. Bonds7

About N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine

N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine (PubChem CID 138727106) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine
PubChem CID138727106
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC NameN-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine
SMILESCCN(C)C[C@H]1CN(CCCC(C)C)CCO1
InChIInChI=1S/C14H30N2O/c1-5-15(4)11-14-12-16(9-10-17-14)8-6-7-13(2)3/h13-14H,5-12H2,1-4H3/t14-/m0/s1
InChIKeyBESZXCDBBQGUQG-AWEZNQCLSA-N
XLogP2.08
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-butylmorpholin-2-yl)methyl]-N-methylethanamine
CID 164557510
(2R)-2,4-bis(4-methylpentyl)morpholine
CID 149421762
N,2-dimethyl-N-[[(2R)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide
CID 138727851
2-(bromomethyl)-4-(4-methylpentyl)morpholine
CID 83168587
[4-(4-methylpentyl)morpholin-2-yl]methanamine
CID 83157184
1-[methyl-[2-[(2R)-4-(4-methylpentyl)morpholin-2-yl]ethyl]amino]propane-2-thiol
CID 170115847
N,2-dimethyl-N-[[(2S)-4-[2-(propylamino)ethyl]morpholin-2-yl]methyl]propan-1-amine
CID 166800661
ethane;N-[[(2S)-4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N,2-dimethylpropan-1-amine;molecular hydrogen
CID 171539494
3-[2-[(dimethylamino)methyl]morpholin-4-yl]propan-1-amine
CID 83831936
2-[4-(4-methylpentyl)morpholin-2-yl]acetic acid
CID 83158040
N-methyl-N-[2-[(2R)-4-(4-methylpentyl)morpholin-2-yl]ethyl]butanamide
CID 155750800
3-[2-[(dimethylamino)methyl]morpholin-4-yl]-N-methylpropan-1-amine
CID 157048783

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine?
The IUPAC name of N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine (CID 138727106) is N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine.
What is the SMILES notation for N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine?
The canonical SMILES for N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine is CCN(C)C[C@H]1CN(CCCC(C)C)CCO1.
What is the InChIKey of N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine?
The InChIKey is BESZXCDBBQGUQG-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H30N2O/c1-5-15(4)11-14-12-16(9-10-17-14)8-6-7-13(2)3/h13-14H,5-12H2,1-4H3/t14-/m0/s1.
What are the key properties of N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine?
N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine has a molecular weight of 242.41 g/mol, XLogP of 2.08, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]ethanamine is sourced from PubChem (CID 138727106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).